Désiré-luc Massart
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Désiré-luc Massartmathematics Degrees
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(Suggest an Edit or Addition)Désiré-luc Massart's Published Works
Number of citations in a given year to any of this author's works
Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author
Published Works
- Handbook of Chemometrics and Qualimetrics: Part A (1997) (2006)
- Chemometrics: A Textbook (1988) (1224)
- The Mahalanobis distance (2000) (1207)
- Handbook of Chemometrics and Qualimetrics (1998) (906)
- Elimination of uninformative variables for multivariate calibration. (1996) (812)
- The Interpretation of Analytical Chemical Data by the Use of Cluster Analysis (1983) (781)
- Guidance for robustness/ruggedness tests in method validation. (2001) (525)
- Neural networks in multivariate calibration. (1998) (407)
- Near-infrared spectroscopy applications in pharmaceutical analysis. (2007) (377)
- Heuristic evolving latent projections: resolving two-way multicomponent data. 2. Detection and resolution of minor constituents (1992) (308)
- Peak purity control in liquid chromatography with photodiode-array detection by a fixed size moving window evolving factor analysis (1991) (289)
- Validation of bioanalytical chromatographic methods. (1998) (284)
- Rough sets theory (1999) (282)
- Alternative k-nearest neighbour rules in supervised pattern recognition : Part 1. k-Nearest neighbour classification by using alternative voting rules (1982) (275)
- Genetic Algorithms as a Tool for Wavelength Selection in Multivariate Calibration (1995) (270)
- D-optimal designs (1995) (266)
- Looking for natural patterns in data: Part 1. Density-based approach (2001) (255)
- Representative subset selection (2002) (247)
- Orthogonal projection approach applied to peak purity assessment. (1996) (240)
- Noise suppression and signal compression using the wavelet packet transform (1997) (232)
- Standardization of near-infrared spectrometric instruments (1996) (207)
- A comparison of two algorithms for warping of analytical signals (2002) (207)
- The influence of data pre-processing in the pattern recognition of excipients near-infrared spectra. (1999) (205)
- Artificial neural networks in classification of NIR spectral data: Design of the training set (1996) (202)
- The Radial Basis Functions — Partial Least Squares approach as a flexible non-linear regression technique (1996) (192)
- Dealing with missing data: Part II (2001) (190)
- Comparison of regularized discriminant analysis linear discriminant analysis and quadratic discriminant analysis applied to NIR data (1996) (189)
- Assessment of new constraints applied to the alternating least squares method (1997) (185)
- Evolving factor analysis (1991) (170)
- Evaluation and optimization of laboratory methods and analytical procedures (1978) (155)
- Standardisation of near-infrared spectrometric instruments: A review (1996) (153)
- Least median of squares: a robust method for outlier and model error detection in regression and calibration (1986) (152)
- Decision criteria for soft independent modelling of class analogy applied to near infrared data (1999) (150)
- Multicriteria decision making: A case study (1991) (149)
- Dealing with missing data (2001) (147)
- Feasibility study for the use of near infrared spectroscopy in the qualitative and quantitative analysis of green tea, Camellia sinensis (L.) (2003) (139)
- Reappraisal of hypothesis testing for method validation : detection of systematic error by comparing the means of two methods or of two laboratories (1995) (139)
- UNEQ: a disjoint modelling technique for pattern recognition based on normal distribution (1986) (138)
- Screening approach for chiral separation of pharmaceuticals (2002) (138)
- Optimization of signal denoising in discrete wavelet transform (1999) (133)
- Automatic program for peak detection and deconvolution of multi-overlapped chromatographic signals part I: peak detection. (2005) (129)
- Projection methods in chemistry (2003) (127)
- Screening approach for chiral separation of pharmaceuticals part II. Reversed-phase liquid chromatography. (2002) (126)
- Resolution of multicomponent overlapped peaks by the orthogonal projection approach, evolving factor analysis and window factor analysis (1997) (122)
- Feature selection in principal component analysis of analytical data (2002) (122)
- Improvement of the piecewise direct standardisation procedure for the transfer of NIR spectra for multivariate calibration (1996) (120)
- Wavelength selection method for multicomponent spectrophotometric determinations using partial least squares (1995) (118)
- Risk of malnutrition in retirement homes elderly persons measured by the "mini-nutritional assessment". (2000) (114)
- The kernel PCA algorithms for wide data. Part I: Theory and algorithms (1997) (113)
- Classification of drugs in absorption classes using the classification and regression trees (CART) methodology. (2005) (112)
- Assessment of metal pollution based on multivariate statistical modeling of 'hot spot' sediments from the Black Sea. (2000) (110)
- Ruggedness tests on the high-performance liquid chromatography assay of the United States Pharmacopeia xxii for tetracycline hydrochloride - a comparison of experimental-designs and statistical interpretations (1995) (109)
- Application of Wavelet Packet Transform in Pattern Recognition of Near-IR Data (1996) (107)
- Application of wavelet transform to extract the relevant component from spectral data for multivariate calibration. (1997) (105)
- Using experimental design to optimize the process parameters in fluidized bed granulation on a semi-full scale. (2001) (104)
- Comparison of multivariate methods based on latent vectors and methods based on wavelength selection for the analysis of near-infrared spectroscopic data (1995) (100)
- Operational definitions of uncertainty (2001) (100)
- Looking for Natural Patterns in Analytical Data, 2. Tracing Local Density with OPTICS (2002) (98)
- Spectral transformation and wavelength selection in near-infrared spectra classification (1995) (98)
- Standardization of near-infrared spectra in the wavelet domain (1997) (97)
- Visual presentation of data by means of box plots (2005) (94)
- Evolving factor analysis in the presence of heteroscedastic noise (1992) (94)
- Comparison of Multivariate Discrimination Techniques for Clinical Data— Application to the Thyroid Functional State (1983) (93)
- Automatic program for peak detection and deconvolution of multi-overlapped chromatographic signals part II: peak model and deconvolution algorithms. (2005) (92)
- Simultaneous optimization of several chromatographic performance goals using Derringer's desirability function (1991) (92)
- ROBUST PRINCIPAL COMPONENTS REGRESSION AS A DETECTION TOOL FOR OUTLIERS (1995) (92)
- Identification of pharmaceutical excipients using NIR spectroscopy and SIMCA. (1999) (91)
- Calibration transfer across near-infrared spectrometric instruments using Shenk's algorithm: effects of different standardisation samples (1994) (91)
- Detection of nonlinearity in multivariate calibration (1998) (90)
- The effect of preprocessing methods in reducing interfering variability from near-infrared measurements of creams. (2004) (89)
- Determination of nitrate and nitrite in vegetables by capillary electrophoresis with indirect detection (1995) (89)
- Prediction of total green tea antioxidant capacity from chromatograms by multivariate modeling. (2005) (89)
- Multivariate adaptive regression splines (MARS) in chromatographic quantitative structure-retention relationship studies. (2004) (88)
- The chemical composition of idiopathic nonarteriosclerotic cerebral calcifications (1975) (87)
- Variation in nutrient intake with dental status, age and odour perception. (1996) (86)
- Comparison of Multivariate Calibration Techniques Applied to Experimental NIR Data Sets (2000) (85)
- Determination of system suitability limits with a robustness test (1999) (85)
- The robust normal variate transform for pattern recognition with near-infrared data (1999) (84)
- Inter-laboratory studies in analytical chemistry (2000) (84)
- Matrix effects in the determination of copper and manganese in biological materials using carbon furnace atomic absorption spectrometry (1976) (84)
- Multivariate determination of the geographical origin of wines from four different countries (2007) (83)
- An analysis of the Washington Conference Report on bioanalytical method validation. (1994) (83)
- Comparison between the direct trilinear decomposition and the multivariate curve resolution-alternating least squares methods for the resolution of three-way data sets (1998) (81)
- Wavelets — something for analytical chemistry? (1997) (81)
- Local modelling with radial basis function networks (2000) (80)
- Rapid screening for chiral separations by short‐end injection capillary electrophoresis using highly sulfated cyclodextrins as chiral selectors (2001) (80)
- Alternative k-nearest neighbour rules in supervised pattern recognition : Part 2. Probabilistic classification on the basis of the kNN method modified for direct density estimation (1982) (80)
- Classification and regression tree analysis for molecular descriptor selection and retention prediction in chromatographic quantitative structure-retention relationship studies. (2003) (79)
- Use of a microcomputer for the definition of multivariate confidence regions in medical diagnosis based on clinical laboratory profiles. (1984) (78)
- Characterisation of reversed-phase liquid chromatographic columns by chromatographic tests. Evaluation of 36 test parameters: repeatability, reproducibility and correlation. (2002) (77)
- Itraconazole Formulation Studies of the Melt-Extrusion Process with Mixture Design (2003) (77)
- Prediction of gas chromatographic retention indexes with topological, physicochemical, and quantum chemical parameters (1983) (75)
- Study of parameters important in the spheronisation process (1993) (74)
- Random correlation in variable selection for multivariate calibration with a genetic algorithm (1996) (74)
- On-Line Monitoring of Powder Blending with Near-Infrared Spectroscopy (1998) (73)
- Validation of alternating least-squares multivariate curve resolution for chromatographic resolution and quantitation (1996) (72)
- The use of wavelets for signal denoising in capillary electrophoresis. (2001) (72)
- Ruggedness tests for a high-performance liquid Chromatographic assay: Comparison of an evaluation at two and three levels by using two-level Plackett-Burman designs (1995) (72)
- Characterisation of reversed-phase liquid chromatographic columns by chromatographic tests. Rational column classification by a minimal number of column test parameters. (2003) (70)
- Multivariate peak purity approaches (1996) (69)
- The application of linear discriminant analysis in the diagnosis of thyroid diseases (1978) (69)
- Application of Radial Basis Functions — Partial Least Squares to non-linear pattern recognition problems: diagnosis of process faults (1996) (69)
- Methods for outlier detection in prediction (2002) (69)
- Comparison of rule-building expert systems with pattern recognition for the classification of analytical data (1987) (68)
- Heroin impurity profiling: trends throughout a decade of experimenting. (2001) (68)
- Least median squares curve fitting using a genetic algorithm (1995) (68)
- Definition and system implementation of strategies for method development of chiral separations in normal- or reversed-phase liquid chromatography using polysaccharide-based stationary phases. (2004) (67)
- Optimization by statistical linear discriminant analysis in analytical chemistry (1979) (67)
- Minimal number of chromatographic test parameters for the characterisation of reversed-phase liquid chromatographic stationary phases. (2002) (67)
- Development of a ginkgo biloba fingerprint chromatogram with UV and evaporative light scattering detection and optimization of the evaporative light scattering detector operating conditions. (2005) (67)
- Estimation of partial least squares regression prediction uncertainty when the reference values carry a sizeable measurement error (2003) (66)
- Modified Algorithm for Standardization of Near-Infrared Spectrometric Instruments (1995) (66)
- Determining orthogonal chromatographic systems prior to the development of methods to characterise impurities in drug substances. (2003) (65)
- Window evolving factor analysis for assessment of peak homogeneity in liquid chromatography (1993) (64)
- Simultaneous separation of ammonium and alkali, alkaline earth and transition metal ions in aqueous-organic media by capillary ion analysis (1994) (64)
- Uniform shell designs for optimization in reversed-phase liquid chromatography (1989) (64)
- Quantitative structure-retention and retention-activity relationships of beta-blocking agents by micellar liquid chromatography. (2001) (62)
- Optimization in locally weighted regression. (1998) (61)
- Electrophoretic separation strategy for chiral pharmaceuticals using highly-sulfated and neutral cyclodextrins based dual selector systems (2004) (61)
- Supervised pattern recognition: the ideal method? (1986) (61)
- Boosting partial least squares. (2005) (61)
- Three-way principal component analysis applied to food analysis: an example (2002) (60)
- Sequential projection pursuit using genetic algorithms for data mining of analytical data. (2000) (60)
- STATIS, a three-way method for data analysis. Application to environmental data (2004) (60)
- Kernel-PCA algorithms for wide data Part II: Fast cross-validation and application in classification of NIR data (1997) (60)
- The use of information theory for evaluating the quality of thin-layer chromatographic separations. (1973) (59)
- Using Experimental Design to Optimize the Process Parameters in Fluidized Bed Granulation (2001) (59)
- Separation strategy of multicomponent mixtures by liquid chromatography with a single stationary phase and a limited number of mobile phase solvents (1984) (59)
- Comparison of different approaches to estimate the uncertainty of a liquid chromatographic assay (2003) (58)
- Selection of reversed-phase liquid chromatographic columns with diverse selectivity towards the potential separation of impurities in drugs. (2004) (58)
- Evaluation of dissolution profiles using principal component analysis. (2001) (58)
- Exploratory chemometric analysis of the classification of pharmaceutical substances based on chromatographic data. (2000) (58)
- Characterisation of reversed-phase liquid-chromatographic columns by chromatographic tests comparing column classification based on chromatographic parameters and column performance for the separation of acetylsalicylic acid and related compounds. (2004) (56)
- Kinetic study of the fluoride electrode in fast flow and automatic systems (1976) (55)
- Application of information theory and numerical taxonomy to the selection of gas-liquid chromatography stationary phases (1975) (55)
- Selection and weighting of samples in multivariate regression model updating (2005) (55)
- Determining orthogonal and similar chromatographic systems from the injection of mixtures in liquid chromatography-diode array detection and the interpretation of correlation coefficients color maps. (2004) (54)
- Chemometric treatment of vanillin fingerprint chromatograms. Effect of different signal alignments on principal component analysis plots. (2006) (54)
- MULTIPLE OUTLIER DETECTION REVISITED (1998) (54)
- Different effects of flavour amplification of nutrient dense foods on preference and consumption in young and elderly subjects (1997) (53)
- Two‐week oral treatment of tinea pedis, comparing terbinafine (250 mg/day) with itraconazole (100 mg/day): a double‐blind, multicentre study (1994) (53)
- Fast separations on monolithic silica columns: method transfer, robustness and column ageing for some case studies. (2003) (53)
- Effects of flavour amplification of Quorn and yoghurt on food preference and consumption in relation to age, BMI and odour perception. (2000) (53)
- Non-linear mixed effects models for the evaluation of dissolution profiles. (2002) (53)
- Scaling-up of a lactose wet granulation process in Mi-Pro high shear mixers. (2002) (53)
- Application of Derringer's desirability function for the selection of optimum separation conditions in capillary zone electrophoresis (1996) (53)
- Robustness testing of a reversed-phase high-performance liquid chromatographic assay: comparison of fractional and asymmetrical factorial designs. (2000) (51)
- A comparison between two robust PCA algorithms (2004) (51)
- Monitoring powder blending by NIR spectroscopy (1995) (50)
- Evaluation of six chiral stationary phases in LC for their selectivity towards drug enantiomers. (1992) (49)
- Resolution of Complex Liquid Chromatography−Fourier Transform Infrared Spectroscopy Data (1997) (49)
- Comparison of semirobust and robust partial least squares procedures (1995) (49)
- An expert system for the selection of criteria for selectivity optimization in high-pressure liquid chromatography (1988) (49)
- Variable selection for neural networks in multivariate calibration (1998) (49)
- Purity assessment and resolution of tetracycline hydrochloride samples analysed using high-performance liquid chromatography with diode array detection (1999) (49)
- Chapter 33 - Supervised Pattern Recognition (1998) (49)
- Scaling up of the fluidized bed granulation process. (2003) (49)
- Analyte isolation by solid phase extraction (SPE) on silica-bonded phases: Classification and recommended practices (Technical Report) (1994) (49)
- Orthogonality and similarity within silica-based reversed-phased chromatographic systems. (2005) (48)
- Application of boosting to classification problems in chemometrics (2005) (48)
- The determination of Cu, Zn, and Mn in subcellular rat liver fractions. (1977) (48)
- An evaluation of direct orthogonal signal correction and other preprocessing methods for the classification of clinical study lots of a dermatological cream. (2002) (48)
- Molecular connectivity and retention indexes. (1977) (47)
- Application of rough set theory to feature selection for unsupervised clustering (2002) (47)
- Enantioselective bioanalysis of beta-blocking agents: focus on atenolol, betaxolol, carvedilol, metoprolol, pindolol, propranolol and sotalol. (1993) (47)
- Rapid development of the enantiomeric separation of beta-blockers by capillary electrophoresis using an experimental design approach. (1999) (47)
- Streaming potentials in automatic potentiometric systems (1974) (46)
- Expert system for pharmaceutical analysis. I. Selection of the detection system in high-performance liquid chromatographic analysis: UV versus amperometric detection. (1985) (46)
- Wavelet packet transform applied to a set of signals: A new approach to the best-basis selection (1997) (46)
- Artificial neural networks in classification of NIR spectral data: Selection of the input (1996) (45)
- Comparison of capillary zone electrophoresis with high-performance liquid chromatography for the determination of additives in foodstuffs. (1993) (45)
- Knowledge-based system for method development of chiral separations with capillary electrophoresis using highly-sulphated cyclodextrins. (2002) (45)
- Algorithm for the assessment of peak purity in liquid chromatography with photodiode-array detection (1994) (45)
- Spectral Mapping Analysis: A Method for the Characterization of Stationary Phases (1994) (44)
- Simultaneous optimization of pH and organic modifier content of the mobile phase for the separation of chlorophenols using a Doehlert design (1993) (44)
- Multivariate adaptive regression splines—studies of HIV reverse transcriptase inhibitors (2004) (44)
- Validation of an HPLC method on short columns to assay ketoconazole and formaldehyde in shampoo. (2003) (44)
- Two-step multivariate adaptive regression splines for modeling a quantitative relationship between gas chromatography retention indices and molecular descriptors. (2003) (44)
- On the Optimal Partitioning of Data with K-Means, Growing K-Means, Neural Gas, and Growing Neural Gas (2002) (43)
- Three-level screening designs for the optimisation or the ruggedness testing of analytical procedures (1993) (43)
- Detection of prediction outliers and inliers in multivariate calibration (1999) (43)
- Multi-way modelling of high-dimensionality electroencephalographic data (2001) (43)
- Method development and optimization for the determination of rare earth metal ions by capillary zone electrophoresis (1993) (43)
- A strategy for the determination of beta blockers in plasma using solid-phase extraction in combination with high-performance liquid chromatography. (1989) (43)
- High-performance liquid chromatographic determination of vinca-alkaloids in plasma and urine. (1985) (42)
- Resolution of multicomponent peaks by orthogonal projection approach, positive matrix factorization and alternating least squares (2000) (42)
- Validation of the calibration procedure in atomic absorption spectrometric methods (1996) (42)
- Multiple factor analysis in environmental chemistry (2005) (42)
- The use of principal components analysis for the investigation of an organic air pollutants data set (1984) (41)
- Simultaneous determination of ketoconazole and formaldehyde in a shampoo: liquid chromatography method development and validation. (2002) (41)
- Distribution of Cu and Zn in human brain tissue. (1974) (41)
- Cd uptake by intact wheat plants (1978) (41)
- Application of the needle algorithm for exploratory analysis and resolution of HPLC-DAD data (1996) (41)
- Danube River Water Data Modelling by Multivariate Data Analysis (2001) (41)
- Determination of alkali and alkaline earth metals in real samples by capillary ion analysis (1994) (40)
- Microwave digestion: an analysis of procedures (1992) (40)
- Chemometric comparison of recent chromatographic and electrophoretic methods in a quantitative structure-retention and retention-activity relationship context. (2003) (40)
- The determination of platinum in biological fluid by means of graphite furnace atomic absorption spectrometry. (1980) (40)
- Comparison of alternative measurement methods (1999) (39)
- Isolation of basic drugs from plasma using solid-phase extraction with a cyanopropyl-bonded phase. (1988) (39)
- Evaluation of the orthogonal projection approach (OPA) and the SIMPLISMA approach on the Windig standard spectral data sets (1997) (39)
- Optimization of partial-least-squares calibration models by simulation of instrumental perturbations (1997) (39)
- Correlation of extrusion forces, raw materials and sphere characteristics (1992) (38)
- Robustness testing of chiral separations by capillary electrophoresis using highly-sulfated cyclodextrins. (2003) (38)
- Artefacts in evolving factor analysis-based methods for peak purity control in liquid chromatography with diode-array detection (1992) (38)
- Reference data sets for chemometrical methods testing (1993) (38)
- An evaluation of the PoLiSh smoothed regression and the Monte Carlo Cross-Validation for the determination of the complexity of a PLS model (2003) (38)
- Expert system for the selection of high-performance liquid chromatographic methods in pharmaceutical analysis. Validation of the rules for the selection of the mobile phase. (1988) (38)
- Alternative k-nearest neighbour rules in supervised pattern recognition : Part 3. Condensed nearest neighbour rules (1982) (37)
- Application of SIMPLISMA for the assessment of peak purity in liquid chromatography with diode array detection (1994) (37)
- Eigenstructure tracking analysis for assessment of peak purity in high-performance liquid chromatography with diode array detection (1995) (37)
- Informing power of a chromatographic method and its use as a quality criterion (1974) (36)
- Transfer of Calibrations of Near-Infrared Spectra Using Neural Networks (1998) (36)
- A ruggedness test strategy for procedure related factors: experimental set-up and interpretation. (1998) (36)
- Odour perception in chronic renal disease. (1997) (36)
- The Selection of Preferred Liquid Phases After Classification By Numerical Taxonomy Techniques (1974) (36)
- Influence of the roll compactor parameter settings and the compression pressure on the buccal bio-adhesive tablet properties. (2001) (36)
- Direct Orthogonalization: some case studies (2001) (36)
- Separation strategy for acidic chiral pharmaceuticals with capillary electrochromatography on polysaccharide stationary phases (2005) (36)
- Susceptibility testing of pathogenic fungi with itraconazole: a process analysis of test variables. (2001) (36)
- Modeling bio-geochemical interactions in the surface waters of the Gulf of Trieste by three-way principal component analysis (PCA) (1999) (35)
- A comparison of multivariate calibration techniques applied to experimental NIR data sets: Part II. Predictive ability under extrapolation conditions (2001) (35)
- Expert systems for chemical analysis (ESPRIT Project 1570) (1988) (35)
- Characterisation of the representativity of selected sets of samples in multivariate calibration and pattern recognition (1997) (34)
- Application of numerical taxonomy techniques to the choice of optimal sets of solvents in thin layer chromatography (1974) (34)
- Chapter 3 Review of the use of robustness and ruggedness in analytical chemistry (1996) (34)
- Knowledge-based system for the automated solid-phase extraction of basic drugs from plasma coupled with their liquid chromatographic determination. Application to the biodetermination of beta-receptor blocking agents. (1994) (34)
- Facilitated Column Ranking and Selection in Reversed-Phase Liquid Chromatographic Analysis (2004) (34)
- Interpretation of migration behaviour of inorganic cations in capillary ion electrophoresis based on an equilibrium model (1995) (34)
- A journey into low-dimensional spaces with autoassociative neural networks. (2003) (33)
- Determination of the number of components during mixture analysis using the Durbin–Watson criterion in the Orthogonal Projection Approach and in the SIMPLe-to-use Interactive Self-modelling Mixture Analysis approach (2002) (33)
- Chemometric analysis of soil pollution data using the Tucker N-way method (2006) (33)
- Method development and validation for the determination of mineral elements in food and botanical materials by capillary electrophoresis (1995) (33)
- Application of neural network calibrations to an halide ISE array. (2000) (33)
- Fast development of separation methods for the chiral analysis of amino acid derivatives using capillary electrophoresis and experimental designs. (2000) (33)
- Robust regression and outlier detection in the evaluation of robustness tests with different experimental designs (2002) (33)
- Food odor thresholds in relation to age, nutritional, and health status. (1995) (33)
- Genetic algorithms (GA) applied to the orthogonal projection approach (OPA) for variable selection (2004) (33)
- Inverse calibration predicts better than classical calibration (1998) (33)
- A three-factor optimisation strategy for micellar liquid chromatography (2000) (32)
- Prediction of gastro-intestinal absorption using multivariate adaptive regression splines. (2005) (32)
- Optimization in Irregularly Shaped Regions: pH and Solvent Strength in Reversed-Phase High-Performance Liquid Chromatography Separations (1994) (32)
- Application of linear mixed effects models to the evaluation of dissolution profiles. (2001) (32)
- The optimal brain surgeon for pruning neural network architecture applied to multivariate calibration (1998) (32)
- A comparison of the heuristic evoling latent projections and evolving factor analysis methods for peak purity control in liquid chromatography with photodiode array detection (1992) (31)
- Influence and correction of temperature perturbations on NIR spectra during the monitoring of a polymorph conversion process prior to self-modelling mixture analysis. (1998) (31)
- Multivariate calibration with Raman spectroscopic data: a case study (2000) (31)
- Determination of nitrate in water with an ammonia probe. (1975) (31)
- EXPERT SYSTEM FOR THE SELECTION OF INITIAL HIGH-PERFORMANCE LIQUID CHROMATOGRAPHIC CONDITIONS FOR THE ANALYSIS OF PHARMACEUTICALS (1989) (31)
- Multivariate analysis of CCSEM auto emission data (1987) (31)
- Detection of inhomogeneities in sets of NIR spectra (1996) (31)
- Solvent extraction procedures for the differential determination of arsenic(V) and arsenic(III) species by electrothermal atomic absorption spectrometry (1982) (31)
- Comparison of classification approaches applied to NIR-spectra of clinical study lots. (1998) (30)
- Application of tetraoxadiaza-crown ether derivatives as chiral selector modifiers in capillary electrophoresis. (2004) (30)
- The use of clustering techniques in the elucidation or confirmation of metabolic pathways. Application to the branched-chain fatty acids present in the milk fat of lactating goats. (1981) (30)
- Improved algorithm for clustering tendency (2000) (30)
- THE DEVELOPMENT OF CALIBRATION MODELS FOR SPECTROSCOPIC DATA USING PRINCIPAL COMPONENT REGRESSION (2006) (29)
- Classification and Regression Trees-Studies of HIV Reverse Transcriptase Inhibitors (2004) (29)
- Comparison of the performance of the class modelling techniques UNEQ, SIMCA, and PRIMA (1988) (29)
- Principal component analysis of dissolution data with missing elements. (2002) (29)
- Using contrasts as data pretreatment method in pattern recognition of multivariate data (1999) (28)
- Experimental design for the rapid selection of separation conditions for methyl and propyl parahydroxybenzoate, phenylephrine hydrochloride and chlorphenamine maleate by ion-pair liquid chromatography. (1994) (28)
- Effect of the scan time on methods based on evolving factor analysis in liquid chromatography (1992) (28)
- Solid-phase extraction of the preservatives sorbic acid and benzoic acid and the artificial sweeteners aspartame and saccharin (1991) (28)
- Evaluation and selection of optimal solvents and solvent combinations in thin-layer chromatography. Application of the method to basic drugs. (1975) (28)
- Evaluation of chemometric techniques to select orthogonal chromatographic systems. (2006) (28)
- Effect of different preprocessing methods for principal component analysis applied to the composition of mixtures: Detection of impurities in HPLC—DAD (1994) (28)
- Detection of bias in method comparison by regression analysis (1997) (28)
- Non-hierarchical clustering with masloc (1983) (28)
- Robust principal components regression based on principal sensitivity vectors (2003) (28)
- Robust regression and outlier detection for non-linear models using genetic algorithms (1995) (28)
- Prediction of gas chromatography retention indexes from linear free energy and topological parameters (1981) (28)
- Comparison of several criteria to decide on the significance of effects in a robustness test with an asymmetrical factorial design (2000) (28)
- Method development and optimization for small ion capillary electrophoresis (1996) (27)
- Determination of uncertainty in analytical measurements from collaborative study results on the analysis of a phenoxymethylpenicillin sample (2003) (27)
- Feature selection in sequential projection pursuit (2001) (27)
- Half-fraction and full factorial designs versus central composite design for retention modelling in reversed-phase ion-pair liquid chromatography. (1996) (27)
- Prediction of the migration behaviour of anions in capillary ion analysis (1994) (27)
- Robust orthogonal regression for the outlier detection when comparing two series of measurement results (1997) (26)
- Application of several modified peak purity assays to real complex multicomponent mixtures by high-performance liquid chromatography with diode-array detection. (1999) (26)
- The application of Kohonen neural networks to diagnose calibration problems in atomic absorption spectrometry. (2000) (26)
- Study of method validation criteria in a capillary electrophoresis method for the separation of non-steroidal anti-inflammatory drugs (2000) (26)
- Extraction of information from large data sets by pattern recognition (1982) (26)
- Model Updating for the Identification of NIR Spectra from a Pharmaceutical Excipient (2000) (26)
- Applications of pattern recognition (1982) (25)
- Nested designs in ruggedness testing. (1999) (25)
- The Selection of Preferred Systems for the HPLC of Basic Drugs. Application to the Separation of Antihistamine Drugs (1980) (25)
- Screening approach for chiral separation of pharmaceuticals. Part I. Normal-phase liquid chromatography. (2002) (25)
- Application of chemometrics for the selection of microwave digestion procedures (1992) (25)
- A non‐parametric class modelling technique (1989) (25)
- A strategy for two-dimensional, high-performance thin-layer chromatography, applied to local anesthetics (1987) (25)
- Critical study of the speciation of aluminum in biological fluids by size-exclusion chromatography and electrothermal atomic absorption spectrometry (1987) (25)
- Development of a generic flow injection analysis method for compounds with a secondary amine or amide function, using an experimental design approach: I. Selection and evaluation of the FIA system parameters (2001) (25)
- Odour perception in relation to age, general health, anthropometry and dental state. (1997) (24)
- Solvation in hydroorganic media—I. Gibbs free energy of transfer for RbCl from cationic glass electrode measurements (1976) (24)
- Performance and characteristics of the fluoride-selective electrode in a flow injection system (1983) (24)
- Selectivity optimization for the separation of chlorophenols in an irregularly shaped experimental region in capillary electrophoresis. (1997) (24)
- Comparison of Prediction- and Correlation-Based Methods to Select the Best Subset of Principal Components for Principal Component Regression and Detect Outlying Objects (1998) (24)
- Influence of the sequence of experiments in a ruggedness test when drift occurs (1997) (24)
- Outlier Detection in Calibration (1990) (24)
- Strategy for the chiral separation of non‐acidic pharmaceuticals using capillary electrochromatography (2005) (24)
- The determination of copper and zinc in biological materials. A comparison of atomic absorption with spectrophotometry and neutron activation. (1973) (24)
- Interlaboratory study of a liquid chromatography method for erythromycin: determination of uncertainty. (2003) (24)
- Retention behaviour of acidic, neutral and basic drugs on a CN column using phosphate buffers in the mobile phase. (1987) (23)
- Calibration of somatic cell count in milk based on near-infrared spectroscopy (2001) (23)
- Efficient determination of the pKa values of six chlorinated phenols by reversed-phase liquid chromatography (1993) (23)
- Correction of non-linearities in spectroscopic multivariate calibration by using transformed original variables and PLS regression (1997) (23)
- Ruggedness tests on the high performance liquid chromatography assay of the United States Pharmacopoeia 23 for tetracycline.HCl: comparison of different columns in an interlaboratory approach. (1996) (23)
- Development of a standardized analysis strategy for basic drugs, using ion-pair extraction and high-performance liquid chromatography - II. Selection of preferred HPLC-systems. (1983) (23)
- Solvation in hydroorganic media—II. Gibbs free energy of transfer for HCl and comparison between Rb+ and H+ ions (1976) (23)
- Potential methods in pattern recognition : Part 2. CLUPOT —an unsupervised pattern recognition technique (1981) (22)
- On-line application of the orthogonal projection approach (OPA) and the soft independent modelling of class analogy approach (SIMCA) for the detection of the end point of a polymorph conversion reaction by near infrared spectroscopy (NIR) (1999) (22)
- Halide ion-selective electrode array calibration. (1999) (22)
- Application of Fourier transform to multivariate calibration of near-infrared data (1998) (22)
- Influence of some matrix elements on the determination of copper and manganese by furnace atomic absorption spectrometry (1978) (22)
- A methodology to detect outliers/inliers in prediction with PLS (2003) (22)
- The separation of some tricyclic antidepressants by high-performance liquid chromatography. (1976) (22)
- Regularised nearest neighbour classification method for pattern recognition of near infrared spectra (1997) (22)
- Averaged and weighted average partial least squares (2004) (22)
- Expert system for pharmaceutical analysis : II. Relative contribution of and rule validation for amperometric detection (oxidation mode) (1985) (22)
- The Use of an Ammonium Selective Electrode for the Automatic Determination of Ammonia in Boiler Feed-Waters (1973) (22)
- Mutlivariate calibration with Raman data using fast principal component regression and partial least squares methods (2001) (21)
- Potential methods in pattern recognition : Part 3. Feature selection with ALLOC (1981) (21)
- Derivation of system suitability test limits from a robustness test on an LC assay with complex antibiotic samples. (2002) (21)
- Exploratory study on median-based robust regression methods for linear calibration in atomic absorption spectrometric analysis (1989) (21)
- Automated recognition of ergogenic aids using Soft Independent Modeling of Class Analogy (SIMCA) (2002) (21)
- Category ratio scale as an alternative to magnitude matching for age-related taste and odour perception (1998) (21)
- Data structures and data transformations for clustering chemical data (2001) (21)
- Expert system for the selection of high-performance liquid chromatographic methods for the analysis of drugs (1989) (20)
- Evaluation of solid-phase extraction of basic drugs from human milk. (1991) (20)
- Interlaboratory studies on two high-performance liquid chromatographic assays for tylosin (tartrate) (1999) (20)
- Delaunay triangulation method for multivariate calibration (2003) (20)
- The selection of representative substances by operations research techniques (1976) (20)
- A robust version of the Tucker3 model (2001) (20)
- Randomisation test for the number of dimensions of the group average space in generalised Procrustes analysis (2002) (20)
- Class identity assignment for amphetamines using neural networks and GC-FTIR data. (2006) (20)
- An operational research model for pattern recognition (1980) (20)
- Density-based clustering for exploration of analytical data (2004) (20)
- Some robust statistical procedures applied to the analysis of chemical data (1991) (19)
- Development of a standardized analysis strategy for basic drugs, using ion-pair extraction and high-performance liquid chromatography - III. Analysis of pharmaceutical dosage forms. (1984) (19)
- Program for Pareto-optimality in multicriteria problems (1990) (19)
- Application of Nonlinear Regression Functions for the Modeling of Retention in Reversed-Phase LC (1994) (19)
- Influence of nicardipine on the pharmacokinetics and pharmacodynamics of propranolol in healthy volunteers. (1990) (19)
- Improving QSAR models for the biological activity of HIV Reverse Transcriptase inhibitors: Aspects of outlier detection and uninformative variable elimination. (2005) (19)
- Iontophoresis: mechanism of action studied by potentiometry and x-ray fluorescence. (1982) (19)
- Evaluation of the enantioselectivity towards β-blocking agents of the α1 glycoprotein type chiral stationary phase: Chiral AGP®glycoprotein type chiral stationary phase: Chiral AGP® (1992) (19)
- Comparison of methods for the estimation of statistical parameters of censored data (2001) (19)
- Chapter 6 Optimization strategies for HPLC and CZE (2000) (19)
- THIN-LAYER CHROMATOGRAPHIC METHOD FOR THE SEPARATION OF RARE EARTHS. (1965) (19)
- The Oreste method for multicriteria decision making in experimental chemistry (1994) (18)
- Development of a standardized analysis strategy for basic drugs using ion-pair extraction and high-performance liquid chromatography. VIII. Method construction for the determination of mebeverine in tablets and biological fluids. (1986) (18)
- Activation analysis of rare earths : Part II. Determination of lutetium in gadolinite (1968) (18)
- Feature reduction by Fourier transform in pattern recognition of NIR data (1996) (18)
- Exploratory analysis for the automated identification of amphetamines from vapour-phase FTIR spectra (2000) (18)
- Direct orthogonal signal correction as data pretreatment in the classification of clinical lots of creams from near infrared spectroscopy data. (2007) (18)
- Combining spectroscopic data (MS, IR): exploratory chemometric analysis for characterising similarity/diversity of chemical structures. (2001) (18)
- Application of the theory of graphs to the optimization of chromatographic separation schemes for multicomponent samples (1972) (18)
- Study of different criteria for the selection of a rugged optimum in high performance liquid chromatography optimisation (1997) (18)
- Enantioseparations by capillary electro‐chromatography: Differences exhibited by normal‐ and reversed‐phase versions of polysaccharide stationary phases (2004) (17)
- The inclusion of double-channel ultraviolet spectrophotometry in an expert system for pharmaceutical analysis (1986) (17)
- Feature selection using the Kalman filter for classification of multivariate data (1996) (17)
- Development of a standardized analysis strategy for basic drugs using ion-pair extraction and high-performance liquid chromatography - I. Philosophy and selection of extraction technique. (1983) (17)
- Evaluating "fast" micellar monolithic liquid chromatography for high-throughput quantitative structure-retention relationship screening. (2004) (17)
- Determination of Cinnarizine in Whole Blood and Plasma by Reversed Phase HFLC and its Application to a Pharmacokinetic Study (1984) (17)
- Determination of the End Point of a Chemical Synthesis Process Using On-Line Measured Mid-Infrared Spectra (2000) (17)
- The thin-layer chromatographic separation of water-soluble food dyes on silica gel layers (1974) (17)
- Determination of vinca alkaloids in mouse tissues by high-performance liquid chromatography. (1992) (16)
- Investigation of sources of variance which contribute to NIR-spectroscopic measurement of pharmaceutical formulations (1997) (16)
- The Neural-Gas network for classifying analytical data (2002) (16)
- Hierarchical nonhierarchical clustering strategy and application to classification of iron meteorites according to their trace element patterns (1982) (16)
- The mean and standard deviation of data, some of which are below the detection limit: an introduction to maximum likelihood estimation (2000) (16)
- Optimisation of the chlorthalidone chiral separation by capillary electrochromatography using an achiral stationary phase and cyclodextrin in the mobile phase (2004) (16)
- RTS, a computer program for the experimental set-up and interpretation of ruggedness tests. (1998) (16)
- Using deepest regression method for optimization of fluidized bed granulation on semi-full scale. (2003) (16)
- Fast monolithic micellar liquid chromatography: an alternative drug permeability assessing method for high-throughput screening. (2004) (16)
- Evaluation of the H-point standard additions method (HPSAM) and the generalized H-point standard additions method (GHPSAM) for the UV-analysis of two-component mixtures. (1999) (16)
- Model building for the prediction of initial chromatographic conditions in pharmaceutical analysis using reversed-phase liquid chromatography (1993) (16)
- SERUM ALUMINIUM MEASUREMENTS IN RENAL BONE DISEASE (1983) (16)
- Chemometrics in pharmaceutical analysis. (1988) (15)
- Triacylglycerol fatty acid composition of milk from periparturient cows during acute Escherichia coli mastitis (1994) (15)
- The use of a chloride-selective combination electrode in an automated continuous potentiometric system (1977) (15)
- Determination of gibbs free energy of transfer for alkali metal chlorides from water to water dimethylsulphoxide mixtures using cationic glass electrodes—a test for the method (1976) (15)
- Chemometric detection of thermally degraded samples in the analysis of drugs of abuse with gas chromatography-Fourier-transform infrared spectroscopy. (2002) (15)
- CRISEBOOK, a hypermedia version of an expert system for the selection of optimization criteria in high-performance liquid chromatography (1992) (15)
- DETERMINATION OF THE REPRESENTATIVITY BETWEEN TWO MULTIDIMENSIONAL DATA SETS BY A COMPARISON OF THEIR STRUCTURE (1998) (15)
- Method validation: software to compare the slopes of two calibration lines with different residual variance (1989) (15)
- Comparative study of topological and linear free energy-related parameters for the prediction of GC retention indices. (1983) (15)
- Extraction of water-soluble acid dyes by ion-pair formation with tri-n-octylamine (1980) (15)
- A small expert system for solid phase extraction (1990) (15)
- CATION-EXCHANGE TECHNIQUES IN RADIOCHEMISTRY. (1971) (15)
- Evaluation of the expert system shells EX-TRAN and TIMM as rule-building tools for classification purposes (1988) (14)
- Effectiveness of palladium as a chemical modifier for the determination of lead in biological materials and foodstuffs by graphite furnace atomic absorption spectrometry (1992) (14)
- Extraction of information from large data sets by pattern recognition (1982) (14)
- Feature selection for hierarchical clustering (2002) (14)
- Assessment of peak homogeneity in liquid chromatography using multivariate chemometric techniques (1993) (14)
- Ion-pair extraction of basic drugs with di(2-ethylhexyl) phosphoric acid (1979) (14)
- Evaluation of the required sample size in some supervised pattern recognition techniques (1989) (14)
- Distribution of Mn in human brain tissue. (1976) (14)
- Evaluation of the enantioselectivity of an ovomucoid and a cellulase chiral stationary phase towards a set of β-blocking agents (1992) (14)
- Determination of leucovorin and 5-fluorouracil in plasma by high-performance liquid chromatography. (1993) (14)
- Development and optimisation of a flow injection assay for fluticasone propionate using an asymmetrical design and the variable-size simplex algorithm. (2000) (14)
- Liquid chromatographic methods for the chiral separation of β-adrenergic blocking agents (1993) (13)
- Comparison of alternative measurement methods: determination of the minimal number of measurements required for the evaluation of the bias by means of interval hypothesis testing (2000) (13)
- Characterization of the similarity of chemical compounds using electrospray ionization mass spectrometry and multivariate exploratory techniques. (2002) (13)
- Correction of non-linearities in spectroscopic multivariate calibration by using transformed original variables. Part II. Application to principal component regression (1999) (13)
- Automatic Potentiometric Analysis of Sodium in River and Mineral Waters (1972) (13)
- Intersite transfer of industrial calibration models (2000) (13)
- Reversed-Phase Liquid Chromatography of β-Adrenergic Blocking Drugs in the Presence of a Tailing Suppressor (1994) (13)
- Three-way Principal Component Analysis for the Visualization of Trace Elemental Patterns in Vegetables after Different Cooking Procedures (2001) (13)
- An experimental design approach to the optimisation of a flow injection analysis method for glycine. (1999) (13)
- Calibration line adjustment to facilitate the use of synthetic calibration samples in near-infrared spectrometric analysis of pharmaceutical production samples (1995) (13)
- Correction for drift in multivariate systems using the Kalman filter (1996) (13)
- Application of DRIFT Spectroscopy for Comparison of Dye Mixtures Extracted from Small Textile Samples (1992) (13)
- Monitoring batch processes with the STATIS approach (2005) (12)
- Integrating expert systems for high-performance liquid chromatographic method development (1991) (12)
- Enantioselective inhibitory effect of nicardipine on the hepatic clearance of propranolol in man. (1994) (12)
- Ruggedness testing of a size-exclusion chromatographic assay for low-molecular-mass polymers (1996) (12)
- Survey of environmental complex systems: pattern recognition of physicochemical data describing coastal water quality in the Gulf of Trieste. (1999) (12)
- A comparison of multivariate calibration techniques applied to experimental NIR data sets. Part III: Robustness against instrumental perturbation conditions (2004) (12)
- Chemometrical exploration of the wet precipitation chemistry from the Austrian Monitoring Network (1988-1999). (2005) (12)
- Determination of amiodarone and desethylamiodarone in plasma with a standardised extraction and chromatographic optimisation procedure. (1988) (12)
- Relationship between gas chromatographic behaviour and topological, physicochemical, and quantum chemically calculated charge parameters for neuroleptica. (1985) (12)
- Similarities and Differences among Multivariate Display Techniques Illustrated by Belgian Cancer Mortality Distribution Data (1988) (12)
- Brain calcification in a case of acute lymphoblastic leukaemia (1975) (12)
- Extraction of organic acids by ion-pair formation with tri-n-octylamine : Part. 1. Extraction Rate and Influence of pH and Ionic Strength (1984) (12)
- Extraction of organic acids by ion-pair formation with tri-n-octylamine. Part 6. Determination of sorbic acid, benzoic acid, and saccharin in yogurt. (1985) (12)
- Chemometrical exploration of an isotopic ratio data set of acetylsalicylic acid (2005) (12)
- The prediction of elution maxima in the gradient elution of rare earths (1968) (12)
- Determination of pentoxifylline and its 5-hydroxy metabolite in human plasma by solid-phase extraction and high-performance liquid chromatography with ultraviolet detection. (1989) (12)
- Relation between solvation as expressed by the Walden product and cation exchange selectivity in water-dimethylsulfoxide (1973) (12)
- Sensory detection of food odour in relation to dental status, gender and age. (1996) (12)
- Feature selection for the discrimination between pollution types with partial least squares modelling (1996) (12)
- Use of experimental design to optimise a flow injection analysis assay for L-N-monomethylarginine. (1999) (12)
- An expert system for the development of analytical procedures: UV spectrophotometric determination of pharmaceutically active substances in tablets (1986) (12)
- Regularised discriminant analysis (RDA) - modelling for the binary discrimination between pollution types (1997) (12)
- Use of the Orthogonal Projection Approach (OPA) to Monitor Batch Processes (2003) (11)
- Local factor analysis of rank-deficient reaction systems. (2006) (11)
- Stationary phase degradation in reversed-phase liquid chromatography: a possible cause of bad predictions in experimental design (1993) (11)
- Multivariate authentication of the geographical origin of wines: a kernel SVM approach (2007) (11)
- Optimization of the separation of (6R)- and (6S)- leucovorin and evaluation of the robustness of the optimum (1992) (11)
- Atomic absorption spectrophotometry of copper and zinc in human brain tissue. A critical investigation of two digestion technicques. (1976) (11)
- Potential methods in pattern recognition: Part 4. A combination of ALLOC and Statistical Linear Discriminant Analysis (1981) (11)
- Development of a standardized analysis strategy for basic drugs using ion-pair extraction and high-performance liquid chromatography - VII. Determination of drugs in plasma. (1985) (11)
- Integration of optimization methodology with expert systems (1989) (11)
- A new method of detecting clustering in the data (1998) (11)
- Selectivity optimization after prediction of the migration behaviour of anions in capillary ion analysis in the presence of micelles (1995) (11)
- Using orthogonal projection approach (OPA) for rank-deficient reaction processes (2006) (10)
- CuBatch, a MATLAB® interface for n-mode data analysis (2005) (10)
- Development of a Standardized Analysis Strategy for Basic Drugs, Using Ion-Pair Extraction and High-Performance Liquid Chromatography PART IV. Application to Solid Pharmaceutical Dosage Forms (1983) (10)
- High performance liquid chromatographic and colorimetric determination of synthetic dyes in gelatin-containing sweets, following polyamide adsorption and ion-pair extraction with tri-n-octylamine. (1983) (10)
- Chapter 7 – Joint Basis and Joint Best-basis for Data Sets (2000) (10)
- Application of Eigenstructure Tracking Analysis and SIMPLISMA to the Study of the Protonation Equilibria of cCMP and Several Polynucleotides. (1996) (10)
- Activation analysis of rare earths : The determination of rare earths in minerals by the single comparator technique (1968) (10)
- High-performance liquid chromatographic determination of navelbine in MO4 mouse fibrosarcoma cells and biological fluids. (1992) (10)
- Analysis of chloride in milk with a specific ion electrode. (1974) (10)
- Feasibility study concerning the use of expert systems for the development of procedures in pharmaceutical analysis. (1986) (10)
- High-performance liquid chromatographic determination of papaverine in whole blood. (1981) (10)
- Problems in method-comparison studies (1993) (9)
- Operations research in analytical chemistry (1975) (9)
- Feasibility study for the construction of an integrated expert system in high-performance liquid chromatography (1992) (9)
- Capillary gas chromatographic determination of vincamine in plasma. (1985) (9)
- Comparison of models and designs for optimisation of the pH and solvent strength in HPLC (1997) (9)
- Application of linear discriminant analysis to the differentiation of pure milk from different species and mixtures. (1977) (9)
- Prediction of Initial Chromatographic Conditions in Reversed-Phase High-Performance Liquid Chromatography (1993) (9)
- Extraction of organic acids by ion-pair formation with tri-n-octylamine : Part 2. Back-extraction (1984) (9)
- Retention prediction for β-adrenergic blocking drugs in normal-phase liquid chromatography (1994) (9)
- Knowledge representation for the selection of methods in analytical chemistry (1988) (9)
- A contribution to the study of fluoride excretion. (1977) (9)
- Potential methods in pattern recognition: Part 5. ALLOC, Action-orientated Decision Making (1982) (9)
- The elimination of potassium activity in activation analysis by isotopic exchange on columns (1970) (9)
- Decision support system for run suitability checking and explorative method validation in electrothermal atomic absorption spectrometry (1996) (9)
- Evaluation and optimal combination of TLC systems for qualitative identification I: sulfonamides. (1977) (9)
- The determination of arsenic by electrothermal atomic absorption spectrometry after liquid—liquid extraction (1983) (9)
- Assessing molecular similarity/diversity of chemical structures by FT-IR spectroscopy. (2001) (9)
- Structure preserving feature selection in PARAFAC using a genetic algorithm and Procrustes analysis (2003) (9)
- Chapter 36 - Multivariate calibration (1998) (8)
- Optimisation of the reversed phase liquid chromatographic separation of atovaquone, proguanil and related substances. (1997) (8)
- Ion-exchange chromatography of calcium and magnesium in mixed dimethyl sulphoxide-water media (1971) (8)
- Solid-phase extraction of small drugs on apolar and ion-exchanging silica bonded phases: towards the development of a general strategy. (1994) (8)
- Method validation: software to plot calibration lines and their response residuals, and to detect outliers according to Cook's distance (1989) (8)
- Reversed-Phase Ion-Pair Chromatography Of Antihistamine Drugs (1980) (8)
- PROLOG, an artificial intelligence language (1985) (8)
- Chapter 15 - Calibration in Wavelet Domain (2000) (8)
- Application of factor analysis and simplex technique to the optimization of a phosphate determination via molybdenum blue (1976) (8)
- Selection of reference or test materials for the validation of atomic absorption food analysis methods. (1996) (8)
- [Odor perception in relation to age, general health, nutritional status, and dental status]. (1997) (7)
- Partial least squares regression with Curds and Whey (2004) (7)
- The determination of aluminum in biological fluids by means of graphite furnace atomic absorption spectrometry. (1980) (7)
- Knowledge-based computer system for the detection of matrix interferences in atomic absorption spectrometric methods (1995) (7)
- An algorithm for fuzzy linear calibration (1990) (7)
- Artificial Neural Networks (1998) (7)
- Comparison of the miniaturised techniques capillary electrochromatography and capillary liquid chromatography for the chiral separation of chlorthalidone. (2004) (7)
- Erratum to “Local modelling with radial basis function networks ” [Chemometrics and Intelligent Laboratory Systems 50 (2000) 179–198] (2000) (7)
- Chapter 28 - Introduction to Part B (1998) (7)
- Using singular value ratio for resolving peaks in HPLC-DAD data sets (2005) (7)
- X-ray fluorescence and potentiometry compared for determining iodine content of thyroid glands. (1979) (7)
- Automated method selection for HPLC analysis of drugs (1987) (7)
- The Law of Mixtures method for multivariate calibration (2003) (7)
- Use of mass spectrometry for assessing similarity/diversity of natural products with unknown chemical structures. (2000) (7)
- The application of multivariate techniques to data from spanish glass-making objects from the Roman Era (1989) (7)
- Determination of vinblastine in MO4 mouse fibrosarcoma cells by high-performance liquid chromatography. (1987) (7)
- Linearization of atomic absorption calibration curves (1992) (7)
- Application of the three-distance clustering method in analytical chemistry (1989) (6)
- A knowledge-based system for the selection of dissolution methods prior to the atomic absorption analysis of drugs (1992) (6)
- Parallel co-ordinate geometry and principal component analysis for the interpretation of large multi-response experimental designs (2002) (6)
- The effect of low-temperature ashing on the structure and composition of mineral components. (1976) (6)
- Updating multivariate calibration with the Delaunay triangulation method: The creation of a new local model (2006) (6)
- INFORMATION THEORY AND ITS APPLICATION TO ANALYTICAL CHEMISTRY (1993) (6)
- Studies of relationship between biological activities and HIV Reverse Transcriptase Inhibitors by Multivariate Adaptive Regression Splines with Curds and Whey (2006) (6)
- Use of pattern-recognition display techniques to visualize the data contained in complex data-bases. A case study (1983) (6)
- Isolation, identification, and determination of food dyes following ion-pair extraction. (1982) (6)
- Detection, interpretation and correction of changes in the instrumental response of near-infrared monochromator instruments over time (1997) (6)
- High-performance liquid chromatography of basic drugs on cyanopropyl-bonded phases: Practical aspects (1989) (6)
- Determination of Organic Nitrogen in Natural Waters by Means of an Ammonia Probe (1975) (6)
- Rapid-scan hydrodynamic voltammetry and cyclic voltammetry of pharmaceuticals in flow injection analysis conditions. (1989) (6)
- Nicardipine does not influence the pharmacokinetics and pharmacodynamics of atenolol. (1990) (6)
- Extraction of organic acids by ion-pair formation with tri-n-octylamine : Part 4. Influence of organic phase composition (1985) (6)
- Merging laboratory information management systems and chemometrics: The pursuit of quality information (1991) (6)
- Resolution of overlapping mid-infrared spectra using SIMPLISMA and a second-order derivative approach (1996) (6)
- Calibration procedures for a halide Ion-Selective Electrode array (1998) (6)
- Separation and determination of the sodium, benzathine and procaine salts of benzylpenicillin by reversed phase high-performance liquid chromatography. (1983) (6)
- MODELLING OF SOLUTE RETENTION IN THE REVERSED-PHASE HIGH-PERFORMANCE LIQUID CHROMATOGRAPHY SYSTEM WITH THE CHEMICALLY BONDED 3-CYANOPROPYL STATIONARY PHASE (1999) (5)
- Activation analysis of rare earths : Part IV.Determination of traces of rare-earth impurities in Gd2O3 (1968) (5)
- Morphological, structural and chemical study of small calcifications. (1973) (5)
- Reversed-Phase High Performance Liquid Chromatography of Pyrazolone Derivates Involving Ion-Pair Formation (1980) (5)
- The slope ranking method, an algorithm for diagnosing linearity of calibration lines (1992) (5)
- Chemometrics and distributed software (1985) (5)
- Multivariate statistical modeling of coastal sediments data (1999) (5)
- The impact of chemometrics on microchemical analysis (1983) (5)
- Investigation of the geographical distribution of female cancer patterns in Belgium using pattern recognition techniques. (1988) (5)
- The star plot: an alternative display method for multivariate data in the analysis of food and drugs. (1998) (5)
- Ion-pair high performance liquid chromatography of synthetic water-soluble acid dyes [Food dyes, food additives, food colorants, food technology, toxicity, chemical analysis]. (1981) (5)
- Improved purity assessment of high-performance liquid chromatography diode array detection data for overcoming the presence of the non-linearity artefact (2000) (5)
- Assessing the Validity of Near-Infrared Monochromator Calibrations over Time (1998) (5)
- Relationship between content limits and assay methods: an interlaboratory statistical evaluation (1992) (5)
- Classification and Regression Trees — Studies of HIV Reverse Transcriptase Inhibitors. (2004) (5)
- PROLOG, conjunctive queries and rules (1985) (4)
- Visualisation of the mineral distribution pattern in breads by principal component analysis (1993) (4)
- Development of a standardized analysis strategy for basic drugs, using ion-pair extraction and high-performance liquid chromatography. VI. Drug level determination in saliva. (1984) (4)
- Gas chromatographic behaviour and pharmacological activity of neuroleptica (1985) (4)
- MNA and odor perception. (1999) (4)
- High-performance liquid chromatographie determination of vinca-alkaloids in plasma and uterine (1986) (4)
- Extraction of organic acids by ion-pair extraction with tri-n-octylamine - VIII. Identification of synthetic dyes in pharmaceutical preparations. (1985) (4)
- Extraction of organic acids by ion-pair formation with tri-n-octylamine. Part V. Simultaneous determination of synthetic dyes, benzoic acid, sorbic acid, and saccharin in soft drinks and lemonade syrups. (1984) (4)
- Comparison of methods for the determination of fluorine in plants (1976) (4)
- Determination of Nitrate Ion in Marine Biotopes with High Nitrate Content by Ultraviolet Spectrophotometry (2010) (4)
- A study of the mechanism of the adsorption on columns of salts the sorption of europium on cadmium oxalate (1969) (4)
- Characterisation of reversed phase liquid chromatographic columns by chromatographic tests. Preliminary experiments and development of the protocol (2002) (4)
- A simple approach for the standardisation of near-infrared filter instruments from monochromator instruments (1996) (4)
- The teaching potential of evaluation and optimization methods in analytical chemistry (1981) (4)
- Updating Multivariate Calibrations with the Delaunay Triangulation Method (2005) (4)
- Determination of Ianthanum in titania by activation analysis (1968) (4)
- Hypertext tools for the selection of dissolution methods prior to the atomic absorption analysis of pharmaca (1993) (4)
- Development of a standardized analysis strategy for basic drugs, using ion-pair extraction and high-performance liquid chromatography. Part V. Separation and determination of aminophenols and phenylenediamine derivatives in hair dye products. (1983) (3)
- A modification of the ICOMP criterion for estimation of optimum complexity of PCR models (2005) (3)
- Potentiometric determination of iodine in pharmaceutical preparations. (1979) (3)
- Chapter 42 - Applications of Operations Research (1998) (3)
- Drug formulary management computer assisted processing of non formulary-drug requests (1987) (3)
- Chapter 35 – Relations between measurement tables (1998) (3)
- Comparison of the elution profiles of a weakly basic drug on cyanopropyl-bonded silica cartridges from different manufacturers and different batches (1992) (3)
- Distribution of Rf values and combination of systems in thin-layer chromatography (1975) (3)
- Cation exchange selectivity in aqueous-organic solvent mixtures, and solvation in the external phase (1976) (3)
- the Application Of Simca Pattern Recognition To The Study Of Autoimmune Atrophic Thyroiditis (1982) (3)
- Iterative least squares method for regression analysis with censored data (2004) (3)
- Chemometrics and Modeling (2001) (3)
- Modelling of solute retention in normal-phase HPLC with the chemically bonded 3-cyanopropyl stationary phase (1998) (3)
- Quality Assurance Principles for Analytical Laboratories : by F. M. Garfield, Association of Official Analytical Chemists, 1984. US$45.50/US$48.50 (outside U.S.A.) (VI + 211 pages) ISBN 0-935584-26-9 (1986) (3)
- [Medical and pharmaceutical applications of principle component analysis]. (1997) (3)
- Display methods for visual comparison of the results of two measurement methods (1994) (3)
- Evaluation of Thin Layer, Paper, and High Performance Liquid Chromatography for Identification of Dyes Extracted as Ion-Pairs with Tri-n-octylamine (1982) (3)
- Calibration of chiral compounds with self-internal standard. Application to calibration of propranolol hydrochloride in capillary zone electrophoresis (2002) (2)
- Extraction of organic acids by ion-pair formation with tri-n-octylamine. Part 7. Comparison of methods for extraction of synthetic dyes from yogurt. (1985) (2)
- Chapter 8 Hard Modelling in Supervised Pattern Recognition (1992) (2)
- Influences of the calcium antagonists nicardipine and nifedipine, and the calcium agonist BAY-K-8644, on the pharmacokinetics of propranolol in rats (1993) (2)
- Increase in plasma propranolol caused by nicardipine is dependent on the delivery rate of propranolol (2004) (2)
- Expert Systems in Chromatography (1993) (2)
- Skills development by project-based education in the food and diet course of a pharmacy program (2007) (2)
- Generation of a random sample from a multivariate normal distribution (1984) (2)
- High pressure liquid chromatographic determination of tartrazine in rice milk following ion-pair extraction with tri-n-octylamine. (1983) (2)
- PROLOG: Arithmetic relations (1986) (2)
- Decision trees for rapid prototyping of expert systems (1991) (2)
- Influence of precision, sample size and design on the beta error of linearity tests (1998) (2)
- Artificial Intelligence: Expert and Knowledge Based Systems (1998) (2)
- Clustering applied to an organic air pollutants data set (1984) (2)
- Expert systems with chemical structure handling capability (1990) (2)
- OPTIMIZATION IN ANALYTICAL CHEMISTRY: A MULTIVARIATE AND MULTICRITERIA PROBLEM (1980) (2)
- Erratum to ``The mean and standard deviation of data, some of which are below the detection limit: an introduction to maximum likelihood estimation'' [Trends Anal. Chem. 19 (2000) 215–222]1 (2000) (1)
- Distribution coefficients of Rb(+) on zirconium phosphate in mixed aqueous-organic media. (1973) (1)
- Densitometry Evaluation of the Arsenic Content of Biological Materials Using the method of Gutzeit (1980) (1)
- Strategic approach for method selection in high-performance liquid chromatography (1994) (1)
- Operational de¢nitions of uncertainty (2001) (1)
- What can chemometrics do for separation science (2004) (1)
- Correspondence analysis on a microcomputer (1987) (1)
- The determination of meprobamate with the NH3 probe. (1977) (1)
- Class definition and mixture class definition by means of construction of convex hull boundaries: application to analysis for animal fat adulteration. (1989) (1)
- The slope ranking method for homoscedastic calibration lines (1995) (1)
- Chapter 41 - Kalman Filtering (1998) (1)
- Simulations of analytical processes using Visual Basic (1992) (1)
- Increasing peak levels of vinblastine given in repeated divided doses. (1992) (1)
- Column selection in pharmaceutical analysis based on column classification using 4 test parameters (2005) (1)
- ON-STREAM DETERMINATION OF AMMONIA IN BOILER FEED-WATER WITH AN AMMONIUM ION SELECTIVE ELECTRODE AND AN AMMONIUM PROBE (1974) (1)
- Routines for method validation using regression methodology. Analysis of variance to investigate linearity (1988) (1)
- The Mean Reactor Cross Section for the (n, p) Reaction on 140Ce (1968) (1)
- Chemical pattern recognition, by O. Štrouf : Research Studies Press, Letchworth, 1986, xvi + 202 pages, price £26.65, ISBN 0-86380-044-0 (1987) (1)
- Development of a system for the detection of interferences during routine analysis by graphite furnace atomic absorption spectrometry (1994) (1)
- Critical investigation of the potentiometric analysis of fluoride and the interpretation of the data obtained in environmental toxicological and population research (1976) (1)
- Dynamic link libraries. I. Introduction (1996) (1)
- Analytical chemistry: An economic view? (1982) (1)
- Kinetics of uptake and release of Cd by potato tissue (1979) (1)
- INTEROBJECT STRUCTURE OF UNGROUPED IRON METEORITES AS REVEALED BY ADVANCED CLUSTERING: METHODS AND CHEMICAL FEATURES (1984) (1)
- Discriminant analysis of parameters referring to the monoclonal cellular event in multiple myeloma and benign monoclonal gammopathy. (1982) (0)
- [The use of computers in the elaboration of separations of inorganic ions by column chromatography]. (1969) (0)
- Monitoring powder blending on-line with NIR-spectroscopy: chemometrical aspects. (1998) (0)
- Chapter 40 - Signal Processing (1998) (0)
- [Automation of potentiometric analysis of fluorides and its applications]. (1974) (0)
- The handling of wide matrices in chemometrics. (1970) (0)
- [Determination of fluoride ion in wine with potentiometry]. (1973) (0)
- Abstracts of papers clinical pharmacological meeting (2005) (0)
- X-Ray Fluorescence and Potentiometry Compared for Determining Iodine Content of ThyroidGlands (2004) (0)
- Computer corner: Clustering with a microcomputer (1983) (0)
- Separation of chelating agents by thin layer chromatography. (1972) (0)
- Determination of uncertainty in a liquid chromatographic method for erythromycin from Interlaboratory study results (2003) (0)
- Differences in cancer mortality in Belgium, with particular reference to gall-bladder cancer. (1986) (0)
- Determination of uncertainty in a LC method for erythromycin from interlaboratory results (2003) (0)
- Youden award for Cliff Spiegelman (and our journal) (1991) (0)
- Separation and determination of sulphonamides in a pharmaceutical dosage form by HPLC using optimisation procedures. (1985) (0)
- Relative Solvation of Silver and Hydrogen Ions in Water - Tert. Butylalcohol Mixtures: Mobilities and Free Enthalpies of Transfer (2010) (0)
- Fluoride selective electrode procedure for fluorated organophosphate cholinesterase inhibitors (2004) (0)
- OptiSim a fast alternative to Kennard and Stone algorithm. (1970) (0)
- Description and implementation of the system for the run suitability check and explorative method validation (1996) (0)
- The Identification of a New Rheumatoid Disease Group by Means of Multivariate Statistical Analysis (1985) (0)
- DETERMINATION OF GIBBS FREE ENERGY OF TRANSFER FOR ALKALI METAL CHLORIDES FROM WATER TO WATER DIMETHYLSULFOXIDE MIXTURES USING CATIONIC GLASS ELECTRODES. A TEST FOR THE METHOD (1976) (0)
- Abstracts of papers Pharmaceutical and biomedical analysis meeting (2005) (0)
- Dynamic link libraries II. Development (1996) (0)
- The chemometrics society (1981) (0)
- Determination of tartrazine in rice milk desserts by HPLC following ion-pair extraction with tri-n-octylamine. Evaluation by collaborative study (1984) (0)
- Observer: Multi- or uni-variate reference regions? (1983) (0)
- STUDY FOR THE ASSISTANCE OF ACTIVATION ANALYSIS OF ISOTOPIC FRACTIONATION OF RARE EARTH OXIDES. (1968) (0)
- International colloquium on wines and wine blending, Aix en provence, France, 4 June 1987 (1988) (0)
- Analytical chemistry - good news from Ghent (1983) (0)
- Recent recommendations for nomenclature by IUPAC (1990) (0)
- COMETT 2 project on chemometrics and qualimetrics (1991) (0)
- Clustering tools for data mining. (1998) (0)
- Classification model: updating for the identification of excipients by NIR-spectroscopy. (1998) (0)
- Development of a knowledge-based system for the autaomated solid-phase extraction of basic drugs from plasma prior to HPLC determination (1993) (0)
- Spectramap: by P.J. Lewi et al. Information Science Department, Janssen Research Foundation, 30 Turnhoutse Weg, 2340 Beerse, Belgium (1987) (0)
- Fortran is Fortran is Fortran (1984) (0)
- Multivariate Calibration with the Delaunay Triangulation Method: Definition of the Calibration Domain (2005) (0)
- ORAL PRES.: The variance of screening- and supersaturated- design results as a measure for the robustness of a method (2004) (0)
- [Fluorine determination in lemonades and mineral waters (author's transl)]. (1982) (0)
- The Classification of Subjects with Joint Complaints on Incomplete Biochemical and Haematological Datasets (1985) (0)
- Feasibility study concerning the use of expert systems for method selection in pharmaceutical analysis (1986) (0)
- Knowledge-based systems for method development in solid-phase extraction (1993) (0)
- 2 Databases and Spreadsheets (1990) (0)
- Analysing mixtures with Curve Resolution: applications of OPA (2003) (0)
- Chapter 39 - Pharmacokinetic Models (1998) (0)
- Improved purity assessment of HPLC-DAD data for overcoming the presence of the non-linearity artefac (2000) (0)
- SOLVATION IN HYDROORGANIC MEDIA. I. GIBBS FREE ENERGY OF TRANSFER FOR RUBIDIUM CHLORIDE FROM CATIONIC GLASS ELECTRODE MEASUREMENTS (1976) (0)
- RECENT ADVANCES IN CONNECTION WITH THE SEPARATION OF RARE EARTHS (1963) (0)
- Clustering for Microanalytical Data (1981) (0)
- Ion‐Association Extraction Combined With Low Temperature Ashing for the Determination of Cadmium in Foodstuffs (2010) (0)
- Software for randomization tests (1990) (0)
- Morphological, physical and chemical characterization of small calcifications after low temperature ashing. (1974) (0)
- A knowledge-based system for developping solid-phase extraction methods with the ASPEC system, chapitre #D-3 (1994) (0)
- SOLVATION IN HYDROORGANIC MEDIA. II. GIBBS FREE ENERGY OF TRANSFER FOR HYDROGEN CHLORIDE AND COMPARISON BETWEEN RUBIDIUM AND HYDROGEN IONS (1976) (0)
- A computer-assisted LC system A Computer-Assisted Chromatography System, by K. Jinno, Hüthig Verlag, Heidelberg, 1990, DM 118.00, US$ 70.00 (v + 271 pages), ISBN: 3-7785-1497-0 (1991) (0)
- Chemometrics in IUPAC (1986) (0)
- A hypermedia knowledge-based system for the automated solid-phase extraction of basic drugs from plasma coupled to their HPLC determination (1993) (0)
- Separation and quantitative determination by HPLC of ergotamine and its stereo-isomer ergotamine in pharmaceutical preparations. (1985) (0)
- Vectors Matrices Operations on Matrices (1998) (0)
- [Radiological and biochemical aspects of basal nuclei calcifications]. (1973) (0)
- Principal components analysis as a tool for the optimization of experimental conditions. (1983) (0)
- Characterisation and classification of reversed-phase liquid chromatographic columns (2004) (0)
- A STUDY OF OXALATES AS STATIONARY PHASES FOR ADSORPTION CHROMATOGRAPHY OF INORGANIC IONS. (1969) (0)
- Discrimination power of the combined measurements of free thyroxine and free triiodothyronine concentration in the evaluation of thyroid function. (1983) (0)
- Regression Methods in Analytical Chemistry: A Comparison of Three Regression Methods on Simulated Data (2010) (0)
- Determination of uncertainty in analytical measurements: Collaborative study of the analysis of phenoxymethylpenicillin (2002) (0)
- POSTER: Chromatographic screening strategies for chiral pharmaceuticals inplemented in a Knowledge-Based System: RPLC and NPLC. (2001) (0)
- Chapter 37 – Quantitative Structure-Activity Relationships (QSAR) (1998) (0)
- ORAL PRES.: Comparison of alternative measurement methods. (1997) (0)
- [Biological calculation methods and their application in pharmaceutical science]. (1998) (0)
- ORAL PRES.: Selection of an orthogonal subset of reversed phase HPLC columns on LC-MS-DAD. (2004) (0)
- Column classification system, Part 1 : Development (2007) (0)
- RP-LC column classification study. Part I : Comparing column classification and column performance for seven different separations (2005) (0)
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