Gordon M. Crippen
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Gordon M. Crippen's AcademicInfluence.com Rankings
Gordon M. Crippenchemistry Degrees
Chemistry
#4375
World Rank
#5452
Historical Rank
Physical Chemistry
#659
World Rank
#712
Historical Rank

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Chemistry
Gordon M. Crippen's Degrees
- PhD Chemistry University of California, Berkeley
- Bachelors Chemistry University of California, Berkeley
Why Is Gordon M. Crippen Influential?
(Suggest an Edit or Addition)Gordon M. Crippen'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
- Distance Geometry and Molecular Conformation (1988) (786)
- Prediction of Physicochemical Parameters by Atomic Contributions (1999) (783)
- Atomic physicochemical parameters for three-dimensional-structure-directed quantitative structure-activity relationships. 2. Modeling dispersive and hydrophobic interactions (1987) (630)
- Atomic Physicochemical Parameters for Three‐Dimensional Structure‐Directed Quantitative Structure‐Activity Relationships I. Partition Coefficients as a Measure of Hydrophobicity (1986) (553)
- Atomic physicochemical parameters for three dimensional structure directed quantitative structure‐activity relationships III: Modeling hydrophobic interactions (1988) (470)
- The theory and practice of distance geometry (1983) (355)
- Significance of root-mean-square deviation in comparing three-dimensional structures of globular proteins. (1994) (340)
- Contact potential that recognizes the correct folding of globular proteins. (1992) (336)
- A novel approach to calculation of conformation: Distance geometry (1977) (161)
- Stable calculation of coordinates from distance information (1978) (156)
- Effects of distance constraints on macromolecular conformation. II. Simulation of experimental results and theoretical predictions (1979) (149)
- The tree structural organization of proteins. (1978) (136)
- Calculation of protein tertiary structure. (1976) (122)
- Size‐independent comparison of protein three‐dimensional structures (1995) (122)
- A combinatorial algorithm for calculating ligand binding (1984) (115)
- Prediction of protein folding from amino acid sequence over discrete conformation spaces. (1991) (108)
- Distance geometry and conformational calculations (1981) (104)
- Prediction of Physicochemical Parameters by Atomic Contributions. (1999) (100)
- Minimization of polypeptide energy. XI. The method of gentlest ascent. (1971) (80)
- Distance geometry approach to rationalizing binding data. (1979) (80)
- Predicting p K a . (2009) (72)
- Purely in silico BCS classification: science based quality standards for the world's drugs. (2013) (66)
- The combinatorial distance geometry method for the calculation of molecular conformation. I. A new approach to an old problem. (1983) (65)
- Use of physicochemical parameters in distance geometry and related three-dimensional quantitative structure-activity relationships: a demonstration using Escherichia coli dihydrofolate reductase inhibitors. (1985) (65)
- Predicting pKa (2009) (64)
- Note rapid calculation of coordinates from distance matrices (1978) (62)
- Combined use of stereospecific deuteration, NMR, distance geometry, and energy minimization for the conformational analysis of the highly .delta. opioid receptor selective peptide [D-Pen2,D-Pen5]enkephalin (1990) (54)
- Fast drug-receptor mapping by site-directed distances: a novel method of predicting new pharmacological leads (1991) (53)
- A 1.8 Å resolution potential function for protein folding (1990) (52)
- Exploring the conformation space of cycloalkanes by linearized embedding (1992) (46)
- Minimization of polypeptide energy. X. A global search algorithm. (1971) (46)
- Conformational analysis by energy embedding (1982) (46)
- SAGA: rapid automatic mainchain NMR assignment for large proteins (2010) (42)
- Linked and threaded loops in proteins (1980) (42)
- Use of Classification Regression Tree in Predicting Oral Absorption in Humans (2004) (39)
- Distance geometry analysis of the benzodiazepine binding site. (1982) (39)
- Modeling the benzodiazepine receptor binding site by the general three-dimensional structure-directed quantitative structure-activity relationship method REMOTEDISC. (1990) (38)
- Analysis of the in vitro antiviral activity of certain ribonucleosides against parainfluenza virus using a novel computer aided receptor modeling procedure. (1989) (38)
- Quantitative structure-activity relationships by distance geometry: systematic analysis of dihydrofolate reductase inhibitors. (1980) (37)
- Easily searched protein folding potentials. (1996) (34)
- Learning about protein folding via potential functions (1994) (34)
- pKa Prediction of Monoprotic Small Molecules the SMARTS Way (2008) (33)
- Why energy embedding works (1987) (32)
- A potential function for protein folding (1991) (32)
- Global energy minimization by rotational energy embedding (1990) (32)
- The combinatorial distance geometry method for the calculation of molecular conformation. II. Sample problems and computational statistics. (1983) (31)
- Minimization of polypeptide energy. 8. Application of the deflation technique to a dipeptide. (1969) (31)
- Data Mining the NCI60 to Predict Generalized Cytotoxicity (2008) (30)
- How many protein folding motifs are there? (1995) (30)
- Disulfide recognition in an optimized threading potential. (2000) (28)
- General distance geometry three-dimensional receptor model for diverse dihydrofolate reductase inhibitors. (1984) (27)
- Quantitative structure-activity relationship by distance geometry: quinazolines as dihydrofolate reductase inhibitors. (1982) (27)
- Chemical Data Mining of the NCI Human Tumor Cell Line Database (2007) (26)
- Residue-residue potential function for conformational analysis of proteins (1981) (25)
- A Cheminformatic Toolkit for Mining Biomedical Knowledge (2007) (25)
- Chemical distance geometry: Current realization and future projection (1991) (25)
- Topology of globular proteins. II. (1975) (24)
- Sidechain and backbone potential function for conformational analysis of proteins. (2009) (21)
- Correlation of sequence and tertiary structure in globular proteins (1977) (20)
- Topology of globular proteins. (1974) (19)
- Distance geometry analysis of the N.M.R. evidence on the solution conformation of bleomycin. (2009) (19)
- Voronoi binding site models (1987) (19)
- Structure and specificity of a human valacyclovir activating enzyme: a homology model of BPHL. (2004) (18)
- Conformational analysis by scaled energy embedding (1984) (18)
- Three-dimensional molecular descriptors and a novel QSAR method. (2002) (18)
- A survey of atom packing in globular proteins. (2009) (17)
- Global optimization and polypeptide conformation (1975) (16)
- Enumeration of cubic lattice walks by contact class (2000) (16)
- CASA: An Efficient Automated Assignment of Protein Mainchain NMR Data Using an Ordered Tree Search Algorithm (2005) (15)
- Failures of inverse folding and threading with gapped alignment (1996) (15)
- Voronoi binding site model of a polycyclic aromatic hydrocarbon binding protein. (1990) (15)
- Quantitative structure-activity relationships by distance geometry: thyroxine binding site. (1981) (15)
- Objective models for steroid binding sites of human globulins (1997) (15)
- Chirality Descriptors in QSAR (2008) (15)
- A potential function for conformational analysis of proteins. (2009) (14)
- Voronoi modeling: the binding of triazines and pyrimidines to L. casei dihydrofolate reductase. (1993) (14)
- Energy embedding of trypsin inhibitor (1982) (14)
- Combined distance geometry analysis of dihydrofolate reductase inhibition by quinazolines and triazines. (1983) (14)
- Voronoi binding site models: Calculation of binding modes and influence of drug binding data accuracy (1989) (13)
- Validation of DAPPER for 3D QSAR: Conformational Search and Chirality Metric (2003) (13)
- Distance constraints on macromolecular conformation. (2009) (13)
- Analysis of cocaine receptor site ligand binding by three-dimensional Voronoi site modeling approach. (1993) (12)
- Evaluation of Ligand Overlap by Atomic Parameters (2001) (12)
- VRI: 3D QSAR at variable resolution (1999) (12)
- A protein folding potential that places the native states of a large number of proteins near a local minimum (2002) (11)
- Conformational sampling by a general linearized embedding algorithm (1992) (10)
- The measurement of molecular diversity by receptor site interaction simulation (1998) (10)
- Conformation of N-acetyl-L-alanine-N'-methylamide in 1,2-dichloroethane by circular dichroism and optical rotatory dispersion (1974) (9)
- Potential Energy Function for Continuous State Models of Globular Proteins (2000) (9)
- Lattice models of protein folding permitting disordered native states (2002) (9)
- A computer model for the 30S ribosome subunit. (1980) (9)
- An alternative approach to distance geometry using L∞ distances (2015) (8)
- Molecular orbital study of the ring nitrogen basicity of various dihydrofolate reductase inhibitors (1985) (7)
- Intervals and the deduction of drug binding site models (1995) (7)
- Minimization of polypeptide energy XII. The methods of partial energies and cubic subdivision (1973) (7)
- A Gaussian statistical mechanical model for the equilibrium thermodynamics of barnase folding. (2001) (7)
- Validation of EGSITE2, a mixed integer program for deducing objective site models for experimental binding data. (1997) (7)
- Failures of inverse folding and threading with gapped alignment. (1996) (7)
- Protein densities. (1979) (6)
- Deduction of Binding Site Structure from Ligand Binding Data (1985) (6)
- Constructing smooth potential functions for protein folding. (2001) (6)
- Use of Classification Regression Tree in Predicting Oral Absorption in Humans. (2005) (6)
- Data Mining the NCI60 to Predict Generalized Cytotoxicity. (2008) (6)
- Deducing molecular similarity using Voronoi binding sites (1993) (5)
- Recognizing protein folds by cluster distance geometry (2005) (5)
- Cluster distance geometry of polypeptide chains (2004) (5)
- Series approximation of protein structure and constructing conformation space (2003) (5)
- A statistical approach to the calculation of conformation of proteins. 1. Theory. (1977) (5)
- DISTANCE GEOMETRY APPROACH TO RATIONALIZING BINDING DATA (1980) (5)
- Chemical Data Mining of the NCI Human Tumor Cell Line Database. (2008) (5)
- A statistical approach to the calculation of conformation of proteins. 2. The reoxidation of reduced trypsin inhibitor. (1977) (5)
- Contact Potential for Global Identification of Correct Protein Folding (1994) (5)
- Statistical mechanics of protein folding by cluster distance geometry (2004) (5)
- Prediction of New Leads from a Distance Geometry Binding Site Model (1983) (4)
- Dimensional oscillation. A fast variation of energy embedding gives good results with the AMBER potential energy function. (2009) (4)
- An iterative refinement algorithm for consistency based multiple structural alignment methods (2006) (4)
- Statistical mechanics of protein folding with separable energy functions (2004) (4)
- Directional structural features of globular proteins. (1977) (3)
- Distance Geometry for Realistic Molecular Conformations (2013) (3)
- Fold Recognition via a Tree (2006) (2)
- Protein folding and fold recognition for square lattice models. (1997) (2)
- Why are binding-site models more complicated than molecules? (1993) (2)
- Fast Drug‐Receptor Mapping by Site‐Directed Distances: A Novel Method of Predicting New Pharmacological Leads. (1991) (1)
- USE OF PHYSICOCHEMICAL PARAMETERS IN DISTANCE GEOMETRY AND RELATED THREE-DIMENSIONAL QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS: A DEMONSTRATION USING ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE INHIBITORS (1985) (1)
- QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP BY DISTANCE GEOMETRY: QUINAZOLINES AS DIHYDROFOLATE REDUCTASE INHIBITORS (1983) (1)
- Toward Correct Protein Folding Potentials (2004) (1)
- Determining contact energy function for continuous state models of globular protein conformations (2000) (1)
- QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS BY DISTANCE GEOMETRY: THYROXINE BINDING SITE (1981) (1)
- COMBINED DISTANCE GEOMETRY ANALYSIS OF DIHYDROFOLATE REDUCTASE INHIBITION BY QUINAZOLINES AND TRIAZINES (1983) (0)
- Cluster Distance Geometry and Protein Folding (2006) (0)
- CONFORMATION OF N-ACETYL-L-ALANINE-N′-METHYLAMIDE IN 1,2-DICHLOROETHANE BY CIRCULAR DICHROISM AND OPTICAL ROTATORY DISPERSION (1974) (0)
- (Probably) all possible protein folds at low resolution. (1996) (0)
- Protein folding potential functions (1995) (0)
- Deducing Objective Site Models by Mixed Integer Programming (1999) (0)
- A GENERAL DISTANCE-GEOMETRY THREE-DIMENSIONAL RECEPTOR MODEL FOR DIVERSE DIHYDROFOLATE REDUCTASE INHIBITORS (1984) (0)
- Reviews in Computational Chemistry, Volume 32 (2022) (0)
- How to describe chirality and conformational flexibility. (2004) (0)
- ISCB/SPRINGER series in computational biology (2014) (0)
- A solvation potential with improved contact definitions and optimized by extensive threading (1999) (0)
- Distance geometry vs . coordinates for protein folding calculations (2007) (0)
- A statistical measure of association and a series expansion of chain conformations (2009) (0)
- Panel Discussion: New Problems that Should be Addressed in the Next Ten Years (1999) (0)
- Conformational Analysis: Homotopy (2002) (0)
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