Peter Willett
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British chemoinformatics researcher
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Chemistry
Peter Willett's Degrees
- Masters Chemistry University of Oxford
- Bachelors Chemistry University of Oxford
Why Is Peter Willett Influential?
(Suggest an Edit or Addition)According to Wikipedia, Peter Willett is an Emeritus Professor of Information Science at the University of Sheffield, England. Life and education Willett was born 20 April 1953, obtained an Honors degree in Chemistry from Exeter College, Oxford in 1975 and then went to the Department of Information Studies, University of Sheffield where he obtained an MSc in Information Studies in 1976. He obtained a PhD in the same department in 1979.
Peter Willett'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
- Development and validation of a genetic algorithm for flexible docking. (1997) (5476)
- Chemical Similarity Searching (1998) (1573)
- Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation. (1995) (1436)
- Recent trends in hierarchic document clustering: A critical review (1988) (898)
- Readings in information retrieval (1997) (682)
- Similarity-based virtual screening using 2D fingerprints. (2006) (671)
- Maximum common subgraph isomorphism algorithms for the matching of chemical structures (2002) (444)
- The Porter stemming algorithm: then and now (2006) (415)
- A genetic algorithm for flexible molecular overlay and pharmacophore elucidation (1995) (329)
- RASCAL: Calculation of Graph Similarity using Maximum Common Edge Subgraphs (2002) (327)
- The limitations of term co-occurrence data for query expansion in document retrieval systems (1991) (322)
- PHARMACOPHORE PERCEPTION , DEVELOPMENT , AND USE IN DRUG DESIGN (2011) (314)
- Identification of tertiary structure resemblance in proteins using a maximal common subgraph isomorphism algorithm. (1993) (294)
- Comparison of Fingerprint-Based Methods for Virtual Screening Using Multiple Bioactive Reference Structures (2004) (272)
- Use of techniques derived from graph theory to compare secondary structure motifs in proteins. (1990) (246)
- Comparison of topological descriptors for similarity-based virtual screening using multiple bioactive reference structures. (2004) (225)
- A graph-theoretic approach to the identification of three-dimensional patterns of amino acid side-chains in protein structures. (1994) (216)
- Automatic Spelling Correction Using a Trigram Similarity Measure (1983) (205)
- Protein Structures and Information Extraction from Biological Texts: The PASTA System (2003) (195)
- New Methods for Ligand-Based Virtual Screening: Use of Data Fusion and Machine Learning to Enhance the Effectiveness of Similarity Searching (2006) (194)
- Grouping of coefficients for the calculation of inter-molecular similarity and dissimilarity using 2D fragment bit-strings. (2002) (193)
- Comparison of algorithms for dissimilarity-based compound selection. (1997) (188)
- A Comparison of Some Measures for the Determination of Inter‐Molecular Structural Similarity Measures of Inter‐Molecular Structural Similarity (1986) (180)
- Key concepts (1997) (172)
- GALAHAD: 1. Pharmacophore identification by hypermolecular alignment of ligands in 3D (2006) (167)
- Comparison of Hierarchie Agglomerative Clustering Methods for Document Retrieval (1989) (166)
- The Effectiveness of Stemming for Natural-Language Access to Slovene Textual Data (1992) (162)
- Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets (2012) (160)
- Algorithms for the identification of three-dimensional maximal common substructures (1987) (159)
- Estimating the recall performance of Web search engines (1997) (154)
- Similarity Searching and Clustering of Chemical-Structure Databases Using Molecular Property Data (1994) (152)
- An evaluation of some conflation algorithms for information retrieval (1981) (148)
- Analysis and Display of the Size Dependence of Chemical Similarity Coefficients (2003) (143)
- Implementation of nearest-neighbor searching in an online chemical structure search system (1986) (142)
- Combination of Similarity Rankings Using Data Fusion (2013) (141)
- Using interdocument similarity information in document retrieval systems (1997) (138)
- Combination of Fingerprint-Based Similarity Coefficients Using Data Fusion (2003) (135)
- Okapi at TREC{7: automatic ad hoc, ltering, VLC and interactive track (1999) (131)
- Heuristics for Similarity Searching of Chemical Graphs Using a Maximum Common Edge Subgraph Algorithm (2002) (131)
- The Effectiveness of Reactant Pools for Generating Structurally-Diverse Combinatorial Libraries (1997) (130)
- Similarity Searching Using Reduced Graphs (2003) (128)
- Searching techniques for databases of two- and three-dimensional chemical structures. (2005) (127)
- Identification of Biological Activity Profiles Using Substructural Analysis and Genetic Algorithms (1998) (126)
- Combinatorial Library Design Using a Multiobjective Genetic Algorithm (2002) (124)
- A Fast Algorithm For Selecting Sets Of Dissimilar Molecules From Large Chemical Databases (1995) (115)
- Hierarchic Agglomerative Clustering Methods for Automatic Document Classification (1984) (113)
- Lead Optimization Using Matched Molecular Pairs: Inclusion of Contextual Information for Enhanced Prediction of hERG Inhibition, Solubility, and Lipophilicity (2010) (109)
- Chemoinformatics - similarity and diversity in chemical libraries. (2000) (109)
- Similarity searching using 2D structural fingerprints. (2011) (109)
- Enhancing the Effectiveness of Virtual Screening by Fusing Nearest Neighbor Lists: A Comparison of Similarity Coefficients (2004) (109)
- Genetic algorithms in molecular recognition and design. (1995) (108)
- Similarity-based approaches to virtual screening. (2003) (107)
- Webometric analysis of departments of librarianship and information science (2000) (105)
- Evaluation of machine-learning methods for ligand-based virtual screening (2007) (104)
- Implementation of nonhierarchic cluster analysis methods in chemical information structure search (1986) (104)
- Protein docking using a genetic algorithm (2001) (101)
- Effectiveness of graph-based and fingerprint-based similarity measures for virtual screening of 2D chemical structure databases (2002) (98)
- Glossary of terms used in computational drug design (IUPAC Recommendations 1997) (1997) (96)
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: Comparison of conformational-searching algorithms for flexible searching (1994) (95)
- Selecting Combinatorial Libraries to Optimize Diversity and Physical Properties (1999) (94)
- Applications of n-grams in textual information systems (1998) (94)
- A bibliometric analysis of the Journal of Molecular Graphics and Modelling. (2007) (93)
- Combination of molecular similarity measures using data fusion (2000) (93)
- Docking small-molecule ligands into active sites. (1995) (93)
- Rapid Quantification of Molecular Diversity for Selective Database Acquisition (1997) (92)
- SuperStar: improved knowledge-based interaction fields for protein binding sites. (2001) (92)
- Similarity methods in chemoinformatics (2009) (90)
- Efficiency of Hierarchic Agglomerative Clustering using the ICL Distributed array Processor (1989) (84)
- Clique-detection algorithms for matching three-dimensional molecular structures. (1997) (83)
- Pharmacophoric pattern matching in files of 3-D chemical structures: election of interatomic distance screens (1986) (83)
- Similarity Searching in Files of Three-Dimensional Chemical Structures. Alignment of Molecular Electrostatic Potential Fields with a Genetic Algorithm (1996) (82)
- Pharmacophoric pattern matching in files of 3d chemical structures: comparison of geometric searching algorithms (1987) (82)
- The effectiveness of stemming for natural‐language access to Slovene textual data (1992) (81)
- Searching for Patterns of Amino Acids in 3D Protein Structures (2003) (79)
- A review of the use of inverted files for best match searching in information retrieval systems (1983) (79)
- MATCH Communications in Mathematical and in Computer Chemistry (2016) (78)
- Enhancing the effectiveness of similarity-based virtual screening using nearest-neighbor information. (2005) (77)
- Analysis of Data Fusion Methods in Virtual Screening: Similarity and Group Fusion (2006) (77)
- Similarity Searching in Files of Three-Dimensional Chemical Structures: Analysis of the BIOSTER Database Using Two-Dimensional Fingerprints and Molecular Field Descriptors (2000) (77)
- Use of a maximum common subgraph algorithm in the automatic identification of ostensible bond changes occurring in chemical reactions (1981) (75)
- Document Retrieval Systems (1988) (75)
- Brief communication: Gender differences in publication and citation counts in librarianship and information science research (2006) (74)
- Scaffold Hopping Using Clique Detection Applied to Reduced Graphs (2006) (74)
- Comparison of Ranking Methods for Virtual Screening in Lead-Discovery Programs (2003) (74)
- Retrieving documents by plausible inference: An experimental study (1989) (73)
- Open-access mega-journals: The future of scholarly communication or academic dumping ground? A review (2017) (73)
- Ligand-Based Virtual Screening Using Bayesian Networks (2010) (73)
- The Calculation of Molecular Structural Similarity: Principles and Practice (2014) (73)
- Structural resemblance between the families of bacterial signal-transduction proteins and of G proteins revealed by graph theoretical techniques. (1990) (71)
- Enhancing the Effectiveness of Ligand‐Based Virtual Screening Using Data Fusion (2006) (71)
- Hierarchic Document Clustering Using Ward's Method. (1986) (70)
- Similarity Searching in Files of Three-Dimensional Chemical Structures: Evaluation of the EVA Descriptor and Combination of Rankings Using Data Fusion (1997) (68)
- A polymerase I palm in adenylyl cyclase? (1997) (67)
- Open-Access Mega-Journals: A Bibliometric Profile (2016) (67)
- Effectiveness of 2D fingerprints for scaffold hopping. (2011) (66)
- Ranking of library and information science researchers: Comparison of data sources for correlating citation data, and expert judgments (2010) (66)
- Biotin carboxylase comes into the fold (1996) (65)
- Evaluation of a novel infrared range vibration-based descriptor (EVA) for QSAR studies. 1. General application (1997) (64)
- Knowledge-Based Interaction Fingerprint Scoring: A Simple Method for Improving the Effectiveness of Fast Scoring Functions (2006) (63)
- Similarity Searching in Files of Three-Dimensional Chemical Structures: Flexible Field-Based Searching of Molecular Electrostatic Potentials (1996) (63)
- Alignment of three-dimensional molecules using an image recognition algorithm. (2004) (62)
- The citedness of publications by United Kingdom library schools (1995) (62)
- The Malaysian Journal of Library and Information Science 2001-2006: A bibliometric study (2008) (62)
- Graph-Theoretic Techniques for Macromolecular Docking (2000) (61)
- Hierarchic document classification using Ward's clustering method (1986) (61)
- Techniques for the calculation of three-dimensional structural similarity using inter-atomic distances (1991) (61)
- Effectiveness of retrieval in similarity searches of chemical databases: a review of performance measures. (2000) (61)
- Designing bioactive molecules : three-dimensional techniques and applications (1998) (60)
- Evaluation of Similarity Measures for Searching the Dictionary of Natural Products Database (2003) (58)
- Document Retrieval Experiments using Indexing Vocabularies of varying Size. Ii. Hashing, truncation, digram and Trigram Encoding of Index Terms (1979) (58)
- Sequence-dependent DNA structure: a database of octamer structural parameters. (2003) (58)
- Designing focused libraries using MoSELECT. (2002) (56)
- Comparison of fragment weighting schemes for substructural analysis (1989) (56)
- Comparison of chemical clustering methods using graph- and fingerprint-based similarity measures. (2003) (55)
- Combination Rules for Group Fusion in Similarity‐Based Virtual Screening (2010) (54)
- Identification of diverse database subsets using property-based and fragment-based molecular descriptions (2002) (54)
- Dissimilarity-Based Algorithms for Selecting Structurally Diverse Sets of Compounds (1999) (53)
- Use of text signatures for document retrieval in a highly parallel environment (1987) (52)
- Effectiveness of query expansion in ranked-output document retrieval systems (1992) (52)
- Measuring the degree of similarity between objects in text retrieval systems (1993) (52)
- Assessment of additive/nonadditive effects in structure-activity relationships: implications for iterative drug design. (2008) (51)
- Chemoinformatics: a history (2011) (51)
- Matching two-dimensional chemical graphs using genetic algorithms (1994) (51)
- Techniques for the measurement of clustering tendency in document retrieval systems (1987) (50)
- The Automatic Detection of Chemical Reaction Sites (1978) (48)
- Stemming and N-gram matching for term conflation in Turkish texts (1996) (48)
- CLIP: Similarity Searching of 3D Databases Using Clique Detection (2003) (47)
- Searching for pharmacophoric patterns in databases of three‐dimensional chemical structures (1995) (47)
- Stemming of Amharic Words for Information Retrieval (2002) (47)
- Proceedings of the 20th annual international ACM SIGIR conference on Research and development in information retrieval (1993) (47)
- Non-hierarchic document clustering using a genetic algorithm (1995) (45)
- Representation, searching and discovery of patterns of bases in complex RNA structures (2003) (45)
- On the Creation of Hypertext Links in Full-Text Documents: Measurement of Inter-Linker Consistency (1994) (45)
- Similarity searching in files of three-dimensional chemical structures: Comparison of fragment-based measures of shape similarity (1994) (45)
- An Introduction to Algorithmic and Cognitive Approaches for Information Retrieval (1995) (44)
- Document clustering using an inverted file approach (1980) (44)
- Query-specific automatic document classification (1985) (44)
- From chemical documentation to chemoinformatics: 50 years of chemical information science (2008) (44)
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: use of bounded distance matrices for the representation and searching of conformationally flexible molecules. (1992) (44)
- Analysis of Data Fusion Methods in Virtual Screening: Theoretical Model (2006) (43)
- SPRITE and ASSAM: web servers for side chain 3D-motif searching in protein structures (2012) (42)
- The scientific impact of the Cambridge Structural Database: a citation‐based study (2010) (42)
- Clustering files of chemical structures using the Székely-Rizzo generalization of Ward's method. (2009) (41)
- Evaluation of a novel molecular vibration-based descriptor (EVA) for QSAR studies: 2. Model validation using a benchmark steroid dataset (1999) (41)
- Clustering Files of Chemical Structures Using the Fuzzy k-Means Clustering Method (2004) (40)
- Visual and computational analysis of structure--activity relationships in high-throughput screening data. (2001) (39)
- Comparison of protein surfaces using a genetic algorithm (1997) (39)
- The EVA spectral descriptor. (2000) (39)
- An Upperbound to the Performance of Ranked-output Searching: Optimal Weighting of Query Terms using a Genetic Algorithm (1996) (39)
- Similarity searching in databases of three-dimensional molecules and macromolecules (1992) (38)
- Virtual Screening Using Binary Kernel Discrimination: Analysis of Pesticide Data (2006) (37)
- Turbo similarity searching: Effect of fingerprint and dataset on virtual‐screening performance (2009) (37)
- Similarity and Dissimilarity Methods for Processing Chemical Structure Databases (1998) (37)
- β—Glucosyltransferase and phosphorylase reveal their common theme (1995) (37)
- Three‐dimensional structural resemblance between leucine aminopeptidase and carboxypeptidase A revealed by graph‐theoretical techniques (1992) (37)
- Similarity searching in files of three-dimensional chemical structures: Representation and searching of molecular electrostatic potentials using field-graphs (1997) (37)
- Computer science research in Malaysia: a bibliometric analysis (2011) (36)
- Effect of Parameter Variations on the Effectiveness of HQSAR Analyses (1999) (36)
- Calculation of Intersubstituent Similarity Using R-Group Descriptors (2003) (36)
- Evaluation of the EVA descriptor for QSAR studies: 3. The use of a genetic algorithm to search for models with enhanced predictive properties (EVA_GA) (2000) (35)
- On the measurement of inter-linker consistency and retrieval effectiveness in hypertext databases (1994) (34)
- Three-dimensional chemical structure handling (1991) (34)
- Using a genetic algorithm to identify common structural features in sets of ligands. (1997) (34)
- Implementation of nonhierarchic cluster analysis methods in chemical information systems: selection of compounds for biological testing and clustering of substructure search output (1986) (33)
- Parallel text searching in serial files using a processor farm (1989) (33)
- Similarity Searching in Databases of Chemical Structures (2007) (33)
- Three‐dimensional structural resemblance between the ribonuclease H and connection domains of HIV reverse transcriptase and the ATPase fold revealed using graph theoretical techniques (1993) (32)
- Identification of Biological Activity Profiles Using Substructural Analysis and Genetic Algorithms. (1998) (32)
- Improving subject retrieval in online catalogues: S. Walker, R.M. Jones. (British Library Research Paper 24). British Library, London (1987) xi + 193 pp. £10. ISBN 0-7123-3129-8. (Distributed by Longwood Publishing Group, Wolfeboro, NH, USA.) (1988) (32)
- "Let the community decide"? The vision and reality of soundness-only peer review in open-access mega-journals (2018) (32)
- Further Development of a Genetic Algorithm for Ligand Docking and Its Application to Screening Combinatorial Libraries (1999) (31)
- Identification of .beta.-sheet motifs, of .psi.-loops, and of patterns of amino acid residues in three-dimensional protein structures using a subgraph-isomorphism algorithm (1994) (31)
- A review of chemical structure retrieval systems (1987) (31)
- An algorithm for the calculation of exact term discrimination values (1985) (31)
- Combining multiple classifications of chemical structures using consensus clustering. (2012) (31)
- A Stemming Algorithm for Latin Text Databases (1996) (31)
- Generation of equifrequent Groups of Words using a Genetic Algorithm (1994) (31)
- Computer storage and retrieval of generic chemical structures in patents. 7. Parallel simulation of a relaxation algorithm for chemical substructure search (1986) (31)
- Implementation and use of an atom-mapping procedure for similarity searching in databases of 3-D chemical structures (1990) (31)
- A Screen Set Generation Algorithm (1979) (30)
- Binning schemes for partition-based compound selection. (1999) (30)
- Graph theoretic methods for the analysis of structural relationships in biological macromolecules (2005) (30)
- Instruct: a teaching package for experimental methods in information retrieval (1988) (29)
- ArticleRank: a PageRank-based alternative to numbers of citations for analysing citation networks (2009) (29)
- Genfold: A genetic algorithm for folding protein structures using NMR restraints (1998) (28)
- Searching for historical word-forms in a database of 17th-century English text using spelling-correction methods (1992) (28)
- Fusing similarity rankings in ligand-based virtual screening (2013) (28)
- Analysis of Neighborhood Behavior in Lead Optimization and Array Design (2009) (28)
- Effectiveness of stemming for Turkish text retrieval (2000) (28)
- Rapid geometric searching in protein structures (1989) (28)
- Searching Databases of Two-Dimensional and Three-Dimensional Chemical Structures Using Genetic Algorithms (1993) (28)
- Analysis and use of fragment-occurrence data in similarity-based virtual screening (2009) (28)
- A fast procedure for the calculation of similarity coefficients in automatic classification (1981) (28)
- Computational methods for the analysis of molecular diversity (1996) (28)
- Prediction of Ion Channel Activity Using Binary Kernel Discrimination (2007) (28)
- The Extent of the Relationship between the Graph-Theoretical and the Geometrical Shape Coefficients of Chemical Compounds (1995) (28)
- Searching for Historical Word Forms in Text Databases using Spelling-Correction Methods: Reverse error and phonetic coding Methods (1991) (28)
- Multiple search methods for similarity-based virtual screening: analysis of search overlap and precision (2011) (28)
- The Representation and Comparison of Hypertext Structures using Graphs in Information Retrieval and (1996) (27)
- Document Retrieval Experiments using Indexing Vocabularies of varying Size. I. Variety Generation Symbols Assigned to the Fronts of Index Terms (1979) (27)
- Automatic generation of alignments for 3D QSAR analyses. (2001) (27)
- Selection of screens for three-dimensional substructure searching (1990) (27)
- Effect of standardization on fragment‐based measures of structural similarity (1993) (27)
- Upperbound procedures for the identification of similar three-dimensional chemical structures (1989) (27)
- Virtual Screening Using Binary Kernel Discrimination: Effect of Noisy Training Data and the Optimization of Performance (2006) (26)
- Definitions of "Dissimilarity" for Dissimilarity-Based Compound Selection (1996) (26)
- Use of Reduced Graphs To Encode Bioisosterism for Similarity-Based Virtual Screening (2009) (26)
- Bit-String Methods for Selective Compound Acquisition (2000) (25)
- GAPDOCK: A genetic algorithm approach to protein docking in CAPRI round 1 (2003) (25)
- A comparison of some hierarchal agglomerative clustering algorithms for structure—property correlation (1982) (25)
- Intelligent Access to Text: Integrating Information Extraction Technology into Text Browsers (2001) (25)
- A bibliometric analysis of the literature of chemoinformatics (2008) (24)
- The use of 2D fingerprint methods to support the assessment of structural similarity in orphan drug legislation (2014) (24)
- Evaluation of molecular similarity and molecular diversity methods using biological activity data. (2004) (24)
- Nearest neighbour searching in serial files using text signatures (1985) (24)
- Identification of target-specific bioisosteric fragments from ligand–protein crystallographic data (2006) (24)
- Academic communities: The role of journals and open-access mega-journals in scholarly communication (2019) (24)
- SIGIR '97 : proceedings of the 20th Annual International ACM SIGIR Conference on Research and Development in Information Retrieval, Philadelphia, Pennsylvania, USA, July 27-July 31, 1997 (1997) (24)
- On the Creation of Hypertext Links in Full-Text Documents: Measurement of Retrieval Effectiveness (1996) (24)
- Bibliographic pattern matching using the ICL Distributed Array Processor (1988) (23)
- Open access megajournals: The publisher perspective (Part 2: Operational realities) (2017) (23)
- An improved algorithm for the calculation of exact term discrimination values (1988) (23)
- The Characteristics of Journal Editorial Boards in Library and Information Science (2013) (22)
- A Comparison of Spelling-Correction Methods for the Identification of Word Forms in Historical Text Databases (1993) (22)
- Matching of Chemical and Biological Structures Using Subgraph and Maximal Common Subgraph Isomorphism Algorithms (1999) (22)
- Transputer implementations of chemical substructure searching algorithms (1988) (22)
- Representing Clusters Using a Maximum Common Edge Substructure Algorithm Applied to Reduced Graphs and Molecular Graphs (2007) (22)
- Effect of Data Standardization on Chemical Clustering and Similarity Searching (2009) (22)
- A publication and citation analysis of the Department of Information Studies, University of Sheffield, 1980-1990 (1992) (21)
- Novel base triples in RNA structures revealed by graph theoretical searching methods (2011) (21)
- Scaffold Searching: Automated Identification of Similar Ring Systems for the Design of Combinatorial Libraries (2002) (21)
- Computational molecular science (2014) (21)
- Efficiency of text scanning in bibliographic databases using microprocessor-based, multiprocessor networks (1988) (20)
- Transitioning from a Conventional to a 'Mega' Journal: A Bibliometric Case Study of the Journal Medicine (2017) (20)
- Descriptor‐Based Similarity Measures for Screening Chemical Databases (2000) (20)
- Follow-up study of graduates from the MSc Information Management programme at the University of Sheffield (1999) (20)
- INSTRUCT: a teaching package for experimental methods in information retrieval. Part I. The users view (1986) (19)
- Calculating the knowledge-based similarity of functional groups using crystallographic data (2001) (19)
- SLASH: a program for analysing the functional groups in molecules. (1998) (19)
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: implementation of flexible searching. (1993) (19)
- Processing morphological variants in searches of Latin text (1996) (19)
- Text Retrieval and Document Databases (1990) (19)
- Searching techniques for databases of protein secondary structures (1989) (18)
- Readers' perceptions of authors' citation behaviour (2013) (18)
- The Use of Similarity and Clustering Techniques for the Prediction of Molecular Properties (1991) (18)
- IMAAAGINE: a webserver for searching hypothetical 3D amino acid side chain arrangements in the Protein Data Bank (2013) (18)
- Similarity Searching in Files of Three-Dimensional Structures: Evaluation of Similarity Coefficients and Standardisation Methods for Field-Based Similarity Searching (1995) (18)
- Quantifying the value of knowledge exports from librarianship and information science research (2013) (18)
- Representation and searching of carbohydrate structures using graph-theoretic techniques. (1997) (18)
- Textual and chemical information processing: different domains but similar algorithms (2000) (18)
- Computer science in Eastern Europe 1989-2014: a bibliometric study (2015) (18)
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: characterization and use of generalized valence angle screens. (1991) (18)
- Development of an atom mapping procedure for similarity searching in databases of three‐dimensional chemical structures (1991) (18)
- Similarity Searching in Databases of Flexible 3D Structures Using Smoothed Bounded Distance Matrices (2003) (18)
- Evaluation of relocation clustering algorithms for the automatic classification of chemical structures (1984) (18)
- The effectiveness of stemming for information retrieval in Amharic (2003) (18)
- Hyperstructure model for chemical structure handling: generation and atom-by-atom searching of hyperstructures (1992) (17)
- Turbo similarity searching: Effect of fingerprint and dataset on virtual-screening performance (2009) (17)
- EVA: A Novel Theoretical Descriptor for QSAR Studies (2002) (17)
- Identification of duplicate and near‐duplicate full‐text records in database search‐outputs using hierarchic cluster analysis (1995) (17)
- Selecting Combinatorial Libraries to Optimize Diversity and Physical Properties. (1999) (17)
- Effective public library outreach to homeless people (2011) (17)
- Criteria for the Selection of Search Strategies in Best-Match Document-Retrieval Systems (1986) (17)
- Maximum Common Subgraph Isomorphism Algorithms (2017) (17)
- Overall introduction (1997) (17)
- Chemoinformatics Research at the University of Sheffield: A History and Citation Analysis (2003) (17)
- Atom-by-atom searching using massive parallelism. Implementation of the Ullmann subgraph isomorphism algorithm on the distributed array processor (1991) (16)
- Automatic classification of chemical structure databases using a highly parallel array processor (1988) (16)
- Identification of research communities in cited and uncited publications using a co-authorship network (2018) (16)
- NASSAM: a server to search for and annotate tertiary interactions and motifs in three-dimensional structures of complex RNA molecules (2012) (16)
- Indexing exhaustivity and the computation of similarity matrices (1980) (16)
- Inverse Frequency Weighting of Fragments for Similarity-Based Virtual Screening (2010) (16)
- The Journal of Mathematical Chemistry: a bibliometric profile (2017) (16)
- Motivations, understandings, and experiences of open‐access mega‐journal authors: Results of a large‐scale survey (2019) (16)
- Evaluation and implementation of topological codes for online compound search and registration (1981) (16)
- The development of computer science research in the People’s Republic of China 2000–2009: a bibliometric study (2013) (16)
- Maximum Common Substructure-Based Data Fusion in Similarity Searching (2015) (16)
- A comparison of some hierarchal monothetic divisive clustering algorithms for structure-property correlation (1983) (16)
- A review of three‐dimensional chemical structure retrieval systems (1992) (16)
- Network design for the implementation of text searching using a multicomputer (1991) (15)
- Webometric analysis of departments of librarianship and information science: a follow-up study (2009) (15)
- An evaluation of document retrieval from serial files using the ICL Distributed Array Processor (1984) (15)
- COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures (2014) (15)
- Molecular diversity techniques for chemical databases (1996) (15)
- Chapter 37 - Glossary of Terms Used in Computational Drug Design (IUPAC Recommendations 1997) (1998) (15)
- Evaluation of a Bayesian inference network for ligand-based virtual screening (2009) (15)
- A structural similarity analysis of double-helical DNA. (2004) (15)
- The Malaysian Journal of Computer Science: a bibliometric study (2009) (14)
- Research degrees in librarianship and information science (1998) (14)
- Open access megajournals: The publisher perspective (Part 1: Motivations) (2017) (14)
- The Evaluation of an Automatically Indexed, Machine-Readable Chemical Reactions File (1980) (14)
- Comparison of chemical similarity measures using different numbers of query structures (2013) (14)
- A note on the use of nearest neighbors for implementing single linkage document classifications (1984) (13)
- Searching and clustering of databases using the ICL distributed array processor (1988) (13)
- Inclusion of Relevance Information in the Term Discrimination Model (1989) (13)
- Clustering tendency in chemical classifications (1985) (13)
- Information retrieval research in the Department of Information Studies, University of Sheffield: 1965-1985 (1987) (13)
- The use of graph theoretical methods for the comparison of the structures of biological macromolecules (1995) (13)
- A citation analysis of the Cambridge Crystallographic Data Centre (2001) (13)
- Nearest Neighbour Searching in Binary Search Trees: Simulation of a Multiprocessor System (1987) (13)
- Chemical structure systems : computational techniques for representation, searching and processing of structural information (1991) (13)
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: use of smoothed bounded distances for incompletely specified query patterns. (1991) (12)
- Similarity‐based data mining in files of two‐dimensional chemical structures using fingerprint measures of molecular resemblance (2011) (12)
- Hyperstructure model for chemical structure handling: Techniques for substructure searching (1994) (12)
- The Production of Machine-Readable Descriptions of Chemical Reactions Using Wiswesser Line Notations (1978) (12)
- Calculation of Substructural Analysis Weights Using a Genetic Algorithm (2015) (12)
- Structural Similarity Measures for Database Searching (2002) (12)
- Similarity-searching and clustering algorithms for processing databases of two-dimensional and three-dimensional chemical structures (1995) (12)
- INSTRUCT: a teaching package for experimental methods in information retrieval.Part II: computational aspects (1986) (12)
- Using nearest‐neighbour searching techniques to access full‐text documents (1991) (11)
- Inter-linker consistency in the manual construction of hypertext documents (1999) (11)
- Non-hierarchical document clustering using the ICL distribution array processor (1987) (11)
- Ligand-based virtual screening using a genetic algorithm with data fusion (2018) (11)
- Unsupervised 3D Ring Template Searching as an Ideas Generator for Scaffold Hopping: Use of the LAMDA, RigFit, and Field-Based Similarity Search (FBSS) Methods (2006) (11)
- Measuring the spatial accuracy of the spatial scan statistic. (2011) (11)
- An algorithm for chemical superstructure searching (1985) (11)
- Bibliometric analysis of Chinese superconductivity research, 1986-2007 (2011) (11)
- Genetic Algorithms for Chemical Structure Handling and Molecular Recognition (1996) (11)
- Interactions Between Weighting Scheme and Similarity Coefficient in Similarity-Based Virtual Screening (2012) (11)
- Use and perceptions of e-books in Derbyshire libraries (2015) (11)
- Bibliometric Analysis of Chinese Research on Cyclization, MALDI-TOF, and Antibiotics (2010) (11)
- Recent developments in chemoinformatics education. (2001) (10)
- Some heuristics for nearest-neighbor searching in chemical structure files (1983) (10)
- Word Variant Identification in Old French (1997) (10)
- A comparison of knowledge‐based and statistically‐based techniques for reference retrieval (1988) (10)
- SIBRIS: the Sandwich Interactive Browsing and Ranking Information System (1989) (10)
- Comparison of Maximum Common Subgraph Isomorphism Algorithms for the Alignment of 2D Chemical Structures (2018) (10)
- Clustering Files of Chemical Structures Using the Fuzzy k-Means Clustering Method. (2004) (9)
- Document Retrieval Using a Serial Bit String Search (1983) (9)
- The use of the World‐Wide Web in UK academic libraries (1995) (9)
- Representing Clusters Using a Maximum Common Edge Substructure Algorithm Applied to Reduced Graphs and Molecular Graphs. (2007) (9)
- Similarity searching in files of three-dimensional chemical structures. Implementation of atom mapping on the distributed array processor DAP-610, the MasPar MP-1104, and the connection machine CM-200 (1994) (9)
- Computational analysis of molecular diversity for drug discovery (1999) (8)
- Genomic Data Analysis Using DNA Structure: An Analysis of Conserved Nongenic Sequences and Ultraconserved Elements (2006) (8)
- The Literature of Chemoinformatics: 1978–2018 (2020) (8)
- A graph-theory method for pattern identification in geographical epidemiology – a preliminary application to deprivation and mortality (2009) (8)
- Graph theoretic methods for the analysis of structural relationships in biological macromolecules: Research Articles (2005) (8)
- Calculation of Structural Similarity by the Alignment of Molecular Electrostatic Potentials (2002) (8)
- The Journal of Chemical Documentation and the Journal of Chemical Information and Computer Sciences: Publication and Citation Statistics (2010) (8)
- Compression of nucleic acid and protein sequence data (1986) (8)
- Structural similarity between binding sites in influenza sialidase and isocitrate dehydrogenase: Implications for an alternative approach to rational drug design (1994) (8)
- Research Paper: Use of Graph Theory to Identify Patterns of Deprivation and High Morbidity and Mortality in Public Health Data Sets (2005) (8)
- Chemical structure processing (1989) (8)
- The Effect of Screen Set Size on Retrieval from Chemical Substructure Search Systems (1979) (8)
- Use of the R-group descriptor for alignment-free QSAR (2005) (8)
- Comparison of US and UK rankings of LIS journals (2017) (8)
- The creation of hypertext linkages in full-text documents (1994) (7)
- Similarity Searching in Databases of Flexible 3D Structures Using Autocorrelation Vectors Derived from Smoothed Bounded Distance Matrices (2006) (7)
- Selection of reagents for combinatorial synthesis using clique detection (1998) (7)
- Molecular similarity considerations in the licensing of orphan drugs. (2017) (7)
- Structural Search Codes for On-Line Compound Registration (1978) (7)
- Searching Techniques for Databases of Three-Dimensional Chemical Structures (2007) (7)
- Modern approaches to chemical reaction searching : proceedings of a conference (1986) (7)
- Text searching algorithms for parallel processors (1987) (7)
- Sampling Consideration in the Selection of Fragment Screens for Chemical Substructure Search Systems (1979) (7)
- Processing of Documents and Queries in a Slovene Language Free Text Retrieval System (1990) (7)
- A Fourier Fingerprint-Based Method for Protein Surface Representation (2005) (7)
- Automated Descriptor Selection and Hyperstructure Generation to Assist SAR Studies (1995) (7)
- The Use of Weighted 2D Fingerprints in Similarity-Based Virtual Screening (2015) (7)
- AN INTRODUCTION TO GENETIC ALGORITHMS AND TO THEIR USE IN INFORMATION RETRIEVAL (1994) (7)
- The effect of subject matter on the automatic indexing of full text (1982) (7)
- Evaluation of Similarity Searching Methods Using Activity and Toxicity Data (1993) (7)
- Open-Access Mega-Journals (2019) (7)
- The Assessment of Research Quality in UK Departments of Library and Information Management (2012) (7)
- beta-Glucosyltransferase and phosphorylase reveal their common theme. (1995) (6)
- Substructure Searching in Files of Three-Dimensional Chemical Structures (1988) (6)
- Paragraph-based nearest neighbour searching in full-text documents (1989) (6)
- 4.08 – Compound Selection Using Measures of Similarity and Dissimilarity (2007) (6)
- Similarity Searching in Chemical Structure Databases (2008) (6)
- Generation and Display of Activity-Weighted Chemical Hyperstructures (2003) (6)
- Validation of graph-theoretical methods for pattern identification in public health datasets (2002) (6)
- Intelligent information retrieval : The case of astronomy and related space sciences, Dordrecht : Kluwer academic publishers (1996) (6)
- Retrieval Of Morphological Variants In Searches Of Latin Text Databases (1997) (6)
- A history of chemoinformatics (2003) (6)
- Calculation of Three-Dimensional Structural Similarity (1993) (6)
- Enhancing the Effectiveness of Fingerprint-Based Virtual Screening: Use of Turbo Similarity Searching and of Fragment Frequencies of Occurrence (2009) (6)
- Computer Techniques for the Indexing of Chemical Reaction Information (1979) (6)
- On the magnitudes of coefficient values in the calculation of chemical similarity and dissimilarity (2005) (6)
- A Bibliometric Study of Quantitative Structure-Activity Relationships and QSAR & Combinatorial Science (2009) (6)
- Similarity Searching in Databases of Flexible 3D Structures Using Smoothed Bounded Distance Matrices. (2003) (6)
- The calculation of intermolecular similarity coefficients using an inverted file algorithm (1982) (6)
- Similarity Searching in Databases of Three-Dimensional Molecules and Macromolecules. (1993) (6)
- A Hyperstructure Model for Chemical Structure Handling: Generation and Atom-by-Atom Searching of Hyperstructures. (1993) (6)
- Evaluation Of Techniques For The Conflation Of Modern And Seventeenth Century English Spelling (1993) (6)
- ‘No comment’? A study of commenting on PLOS articles (2020) (6)
- Software and hardware techniques for string searching in serial document databases (1988) (5)
- Angular Spectroscopy: Rapid Visualization of Three-Dimensional Substructure Dissimilarity Using Valence Angle or Torsional Descriptors (1995) (5)
- Similarity Searching in Files of Three‐Dimensional Chemical Structures: Analysis of the BIOSTER Database Using Two‐Dimensional Fingerprints and Molecular Field Descriptors. (2000) (5)
- A Qualitative Comparison of Wiswesser Line Notation Descriptors of Reactions and the Derwent Chemical Reaction Documentation Service (1979) (5)
- 1 PHARMACOPHORE PERCEPTION , DEVELOPMENT , AND USE IN DRUG (2011) (5)
- United Kingdom regional newspapers on the World Wide Web (1999) (5)
- New developments in the spatial scan statistic (2013) (5)
- Non-hierarchic document clustering (1995) (5)
- Chemical graph matching using transputer networks (1988) (5)
- Textual and chemical information processing using parallel computer hardware (1989) (5)
- Unfair Means: Use Cases Beyond Plagiarism (2015) (5)
- The assessment of quality maturity levels in Nigerian university libraries (2017) (5)
- A survey of hypertext-based public-access point-of information systems in UK libraries (1995) (5)
- Chemoinformatics: an application domain for information retrieval techniques (2004) (5)
- Parallel database processing: Text retrieval and cluster analysis using the DAP (1990) (4)
- Dissimilarity-based compound selection for library design (2001) (4)
- Representation and Searching of Chemical-Structure Information in Patents (2011) (4)
- Similarity Searching in Files of Three-Dimensional Chemical Structures: Evaluation of the EVA Descriptor and Combination of Rankings Using Data Fusion. (1997) (4)
- Similarity Searching in Databases of Three-Dimensional Chemical Structures (1994) (4)
- Molecular Similarity Approaches in Chemoinformatics: Early History and Literature Status (2016) (4)
- Subset-Selection Methods For Chemical Databases (2002) (4)
- The Information School at the University of Sheffield, 1963-2013 (2014) (4)
- Method for generating a chemical reaction index for storage and retrieval of information. Comments (1981) (4)
- Representation and Searching of 3-D Protein Structures (1993) (4)
- Drug screening with Elastic-net multiple kernel learning (2013) (4)
- Chemoinformatics at the University of Sheffield 2002–2014 (2015) (4)
- Chemoinformatics techniques for data mining in files of two-dimensional and three-dimensional chemical molecules. (2005) (4)
- PROTEP: A Program for Graph-Theoretic Similarity Searching of the 3-D Structures in the Protein Data Bank (1995) (4)
- Paragraph-based access to full-text documents using a hypertext system (1991) (4)
- Searching Techniques for Databases of Three-Dimensional Chemical Structures. (1994) (4)
- Nearest-neighbour Searching in Files of Text Signatures Using Transputer Networks (1991) (4)
- Cross‐Classified Multilevel Modelling of the Effectiveness of Similarity‐Based Virtual Screening (2018) (4)
- Transforming Digital Worlds (2018) (3)
- Generation and Display of Activity-Weighted Chemical Hyperstructures. (2003) (3)
- The use of hypertext in libraries in the United Kingdom (1994) (3)
- The Journal of Computer-Aided Molecular Design: a bibliometric note (2011) (3)
- New Methods for Similarity-based Virtual Screening (2006) (3)
- The Malaysian Journal of Computer Science 1996-2006: a bibliometric study (2009) (3)
- The use and value of MSc in information studies/information management dissertations at the University of Sheffield (1997) (3)
- A sphere-based descriptor for matching protein structures (2002) (3)
- A study on the use of Gumbel approximation with the Bernoulli spatial scan statistic (2013) (3)
- A Power-Enhanced Algorithm for Spatial Anomaly Detection in Binary Labelled Point Data Using the Spatial Scan Statistic (2010) (3)
- A spatial accuracy assessment of an alternative circular scan method for Kulldorff's spatial scan statistic (2009) (3)
- Paragraph-based Searching in Full-Text Documents (1989) (3)
- Weighting of search terms (1988) (3)
- Quality Management Approaches in Academic Libraries: A Pilot Study of a Nigerian University Library (2015) (3)
- Use Of Graph Theory For Data Mining In Public Health (2002) (2)
- Chemical structure retrieval : a review of current research in the Department of Information Studies, University of Sheffield (1990) (2)
- A Simulation Study of the Use of Similarity Fusion for Virtual Screening (2011) (2)
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: characterization and use of generalized torsion angle screens. (1991) (2)
- Introduction to three-dimensional chemical structure handling (1990) (2)
- On the Non-Random Nature of the Nearest-Neighbour Document Clusters (1993) (2)
- Chemical Structure Handling Using the Distributed Array Processor (1993) (2)
- Perspectives from Medicinal Chemistry (2012) (2)
- Processing of chemical structure databases using parallel computer hardware (1989) (2)
- Evaluation of clustering methods for automatic document classification : final report for the period October 1982 to September 1984 : report to the British Library Research and Development Department on project SI/G/564 (1984) (2)
- Free text retrieval systems: a review and evaluation (1989) (2)
- Chemical databases processing using parallel computer hardware. (1989) (2)
- Secondary school librarians as heads of department in UK schools (2011) (2)
- Ligand-based virtual screening using binary kernel discrimination (2005) (2)
- A line graph algorithm for clustering chemical structures based on common substructural cores (2003) (2)
- The soul of a new machine : Tracy Kidder. London: Allen Lane, 1982. ISBN 0 7139 1482 3. £7.50 (1983) (2)
- Ask the experts: focus on computational chemistry. (2011) (2)
- Library Review 1989–2017: publication and citation statistics (2020) (2)
- Parsimonious Kernel Fisher Discrimination (2007) (2)
- A simulation study of the use of similarity fusion for ligand-based virtual screening (2010) (2)
- Use of the INSTRUCT Text Retrieval Program at the Department of Information Studies, University of Sheffield. (1989) (2)
- The Evaluation of Retrieval Effectiveness in Chemical Database Searching (2005) (2)
- Structure and singly occupied molecular orbital analysis of anionic tautomers of guanine (2008) (2)
- The Assessment of Research Quality in United Kingdom Departments of Library and Information Management (2012) (2)
- Chemical Structure Handling (2000) (2)
- Information retrieval and chemoinformatics: is there a bibliometric link? (2010) (2)
- The impact of the Cambridge Structural Database and the small molecule crystal structures it contains: a bibliographic and literature study (2020) (2)
- Pattern Identification in Public Health Data Sets: The Potential Offered by Graph Theory (2007) (2)
- A bibliometric analysis of the Journal of Molecular Graphics and Modelling: An update. (2022) (2)
- Guest Editorial: The Information School at The University of Sheffield (2011) (2)
- A tribute of Michael F. Lynch (1991) (1)
- Searching of chemical structure data bases with parallel computer hardware (1990) (1)
- In memoriam: Karen Spärck Jones (2007) (1)
- Development and Validation of the EVA Descriptor for QSAR Studies (1999) (1)
- Digital libraries in chemistry: providing access to chemical structure information (2004) (1)
- How Students Use E-Books – Reading or Referring? (2017) (1)
- Mining for Context‐Sensitive Bioisosteric Replacements in Large Chemical Databases (2012) (1)
- Current research into chemical and textual information retrieval at the department of information studies, University of Sheffield (1987) (1)
- Editorial: Celebrating 50 years (2013) (1)
- A pilot inference study for a beta-Bernoulli spatial scan statistic (2012) (1)
- Academics’ experience of copyright (2019) (1)
- Comments on "On Bibliometric Analysis of Chinese Research on Cyclization, MALDI-TOF, and Antibiotics: Methodological Concerns" (2011) (1)
- Special Issue: Chemoinformatics (2016) (1)
- Applications of Information Retrieval Methods in Computer-Aided Drug Discovery (2001) (1)
- Structural Fingerprints of Transcription Factor Binding Site Regions (2009) (1)
- Book review: Parallel processing in information systems: John W. Van Zandt (1993) (0)
- 'PhiloFacs': a Tool for Searching Latin Text Databases (1997) (0)
- EVA QSAR: Development of Models with Enhanced Predictivity (EVA_GA) (2000) (0)
- Searching three-dimensional chemical structure databases : current status and future trends (1993) (0)
- USING CHEMOINFORMATICS TOOLS TO ANALYZE CHEMICAL ARRAYS IN LEAD OPTIMIZATION (2013) (0)
- Erratum (1985) (0)
- Special issue in honour of the 40th anniversary of the founding of the Department of Information Studies at the University of Sheffield (2003) (0)
- Lab report special section: information retrieval research in the University of Sheffield (1997) (0)
- Invited panel discussion distributed sensor networks (2007) (0)
- The Effectiveness of Reactant Pools for Generating Structurally- Diverse Combinatorial Libraries. (2010) (0)
- Basic statistics for librarians: I.S. Simpson., (2nd ed). London: Clive Bingley, 1983. 238pp. ISBN 085157 3525. £9.75 (1984) (0)
- Use of Angular Information in Three-Dimensional Substructure Searching Systems (1993) (0)
- Academic communities (2019) (0)
- Advances in Mathematical Chemistry and Applications Volume 1 (Revised Edition) (2015) (0)
- A genetic algorithm for the generation of equifrequently occurring groups of attributes (1997) (0)
- Commentary: the first twelve years of the Journal of chemoinformatics (2022) (0)
- Combining similarity coefficients using data fusion (2002) (0)
- Searching for Patterns of Amino Acids in 3D Protein Structures. (2003) (0)
- IEEE AEROSPACE & ELECTRONIC SYSTEMS SOCIETY ORGANIZATION OFFICERS (2011) (0)
- Searching for angular patterns in files of three-dimensional chemical structures (1991) (0)
- New techniques for dissimilarity-based compound selection (1996) (0)
- Education for chemoinformatics (2006) (0)
- Book reviewText retrieval: A directory of software : R. Kimberly (Editor). Aldershot: Gower, 1987. ISBN 0 566 05372 01. £45.00 (1988) (0)
- Rational Use of Chemical and Sequence Databases (1994) (0)
- Similarity‐Based Scaffold Hopping Using 2D Fingerprints (2013) (0)
- Chemoinformatics Techniques for Processing Chemical Structure Databases (2006) (0)
- Some Current Information Retrieval Research in the United Kingdom (2007) (0)
- Best match searching (1988) (0)
- Computer and information science (2014) (0)
- Calculation of Intersubstituent Similarity Using R‐Group Descriptors. (2003) (0)
- Similarity Searching Using Reduced Graphs. (2003) (0)
- VIRTUAL SCREENING USING BINARY KERNEL DISCRIMINATION (2003) (0)
- Forty years on: the Department of Information Studies at the University of Sheffield (2003) (0)
- Similarity Searching In Chemical Databases Using Molecular Fields And Data Fusion (2001) (0)
- Identification of research communities in cited and uncited publications using a co-authorship network (2018) (0)
- Use of text signatures for retrieval in a hi p aI (2003) (0)
- Editorial: special issue on information retrieval (1995) (0)
- Data handling for science and technology: S.A. Rossmassler and D.G. Watson (Editors). Amsterdam: North-Holland, 1980. 184 pp. ISBN 0 444 86012 6 $25.00 (1982) (0)
- Processing of chemical and textual databases using the ICL DAP and transputer networks (1989) (0)
- ACCIDENT DATA COLLECTION (1979) (0)
- Book reviews (1996) (0)
- Proceedings of the 16th Annual International ACM-SIGIR Conference on Research and Development in Information Retrieval. Pittsburgh, PA, USA, June 27 - July 1, 1993 (1993) (0)
- Recent studies for optimising similarity-based virtual screening (2009) (0)
- megajournals : The publisher perspective ( Part 1 : Motivations ) (2019) (0)
- NMR restraints GENFOLD : A genetic algorithm for folding protein structures using service (2002) (0)
- Ranking and Clustering of Chemical Structure Databases (1988) (0)
- Title : “ No comment ” ? : A study of commenting on (2018) (0)
- Retrieval Of Morphological Variants In Searches Of (1998) (0)
- Illustrative computer programming for libraries. Selected examples for information specialists : C.H. Davis and G.W. Lumsden. (2nd edn) London: Aldwych Press, 1981. ISBN 0 86172 027 X. £9.95 (1983) (0)
- approach to rational drug design and isocitrate dehydrogenase : Implications for an alternative Structural similarity between binding sites in influenza sialidase data (2002) (0)
- Gerard (Gerry) Salton (1996) (0)
- Structural DNA Profiles: Single Sequence Queries (2006) (0)
- Book review: Text retrieval: A directory of software (1988) (0)
- Guest Editorial (2003) (0)
- Editorial (2007) (0)
- End-user searching of bibliographic databases: evaluation of an experimental best match retrieval system (1990) (0)
- Chemoinformatics: the first half century (2012) (0)
- Evolutionary Computation in Practice: Case Studies (1997) (0)
- A teaching package for experimental methods in information retrieval : final report for the period October 1983 to September 1985 : report to the British Library Research and Development Department on project SI/G/599 (1988) (0)
- Guest Editorial (2011) (0)
- Electronic structure theory (2014) (0)
- Introduction to computer-assisted combinatorial chemistry (2001) (0)
- Selection of reagents for combinatorial synthesis using clique detection: Clique Detection and Reagent Selection (1998) (0)
- Mark Hepworth: in memoriam (2017) (0)
- Theoretical and physical chemistry (2014) (0)
- Report on attendance at the 1986 ACM Conference on Research and Development in Information Retrieval, 8 - 11th September 1986 (1986) (0)
- BOARD OF GOVERNORS 2011 (2011) (0)
- On the significance of topological-indices based non-binary molecular similarity measures (2004) (0)
- Combinatorial libraries and the evaluation of diversity (2002) (0)
- Technical paper review committee (2011) (0)
- Other research areas (1988) (0)
- Response to Comment on "The Extent of the Relationship between the Graph-Theoretical and the Geometrical Shape Coefficients of Chemical Compounds" (1995) (0)
- Unsupervised 3D Ring Template Searching as an Ideas Generator for Scaffold Hopping: Use of the LAMDA, RigFit, and Field‐Based Similarity Search (FBSS) Methods. (2006) (0)
- Information UK 2000 : the technological imperative (1990) (0)
- Computer analysis of chemical reaction information for storage and retrieval. (1978) (0)
- New courses for a developing marketplace (2003) (0)
- HIERARCHIC DOCUMENT CLUSTERING USING WARD'S METHOD A. EL-HAUDOUCHI and P. WILLETT (1999) (0)
- Structure and mechanism (2014) (0)
- Book reviews (1993) (0)
- The role of the music specialist in music collections in English public libraries (2010) (0)
- Automatic indexing of documents and queries (1988) (0)
- Book reviews (1987) (0)
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