Richard D. Cramer
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Chemistry
Richard D. Cramer's Degrees
- PhD Chemistry University of California, Berkeley
- Bachelors Chemistry University of California, Berkeley
Why Is Richard D. Cramer Influential?
(Suggest an Edit or Addition)Richard D. Cramer'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
- Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins. (1988) (3438)
- Validation of the general purpose tripos 5.2 force field (1989) (2366)
- QSAR modeling: where have you been? Where are you going to? (2014) (1232)
- Crossvalidation, Bootstrapping, and Partial Least Squares Compared with Multiple Regression in Conventional QSAR Studies (1988) (787)
- Neighborhood behavior: a useful concept for validation of "molecular diversity" descriptors. (1996) (440)
- Recent advances in comparative molecular field analysis (CoMFA). (1989) (277)
- The Probability of Chance Correlation Using Partial Least Squares (PLS) (1993) (265)
- Olefin Coordination Compounds of Rhodium: The Barrier to Rotation of Coordinated Ethylene and the Mechanism of Olefin Exchange (1964) (205)
- Partial Least Squares (PLS): Its strengths and limitations (1993) (189)
- Topomer CoMFA: a design methodology for rapid lead optimization. (2003) (170)
- Comparative molecular field analysis (CoMFA). 2. Toward its use with 3D-structural databases (1990) (164)
- The Mechanism of Isomerization of Olefins with Transition Metal Catalysts (1966) (145)
- Comparative molecular field analysis (1991) (125)
- μ-Dichlorotetraethylenedirhodium(I) (1962) (120)
- Bioisosterism as a molecular diversity descriptor: steric fields of single "topomeric" conformers. (1996) (111)
- Substructural analysis. A novel approach to the problem of drug design. (1974) (111)
- Homogeneous Hydrogenations with Platinum-Tin Chloride Complexes (1963) (107)
- "Lead hopping". Validation of topomer similarity as a superior predictor of similar biological activities. (2004) (102)
- Olefin Coordination Compounds of Rhodium. II. The Mechanism of Ethylene Dimerization (1965) (101)
- BC(DEF) parameters. 1. The intrinsic dimensionality of intermolecular interactions in the liquid state (1980) (101)
- Prospective identification of biologically active structures by topomer shape similarity searching. (1999) (96)
- Bond Character and Conformational Equilibration of Ethylene- and Tetrafluoroethylenerhodium Complexes from Nuclear Magnetic Resonance Spectra (1969) (95)
- Computer-assisted synthetic analysis. Facile man-machine communication of chemical structure by interactive computer graphics (1972) (85)
- Olefin coordination compounds of rhodium. V. Relative stabilities and rates of exchange of olefin complexes of rhodium(I) (1967) (83)
- Three-dimensional structure-activity relationships. (1988) (79)
- Transition metal catalysis exemplified by some rhodium-promoted reactions of olefins (1968) (79)
- Topomers: A Validated Protocol for Their Self-Consistent Generation (2004) (78)
- Olefin Coordination Compounds of Rhodium. III. The Mechanism of Olefin Isomerization (1966) (74)
- Toward general methods of targeted library design: topomer shape similarity searching with diverse structures as queries. (2000) (70)
- Nickel-catalyzed displacement reactions of aryl halides (1975) (70)
- Virtual Compound Libraries: A New Approach to Decision Making in Molecular Discovery Research (1998) (68)
- Crystal structure of (C5H5)Rh(C2F4) (C2H4). Comparison of rhodium-ethylene and rhodium-tetrafluoroethylene bonding (1972) (66)
- The inevitable QSAR renaissance (2011) (61)
- BC(DEF) parameters. 2. An empirical structure-based scheme for the prediction of some physical properties (1980) (54)
- Five-Coordinate Platinum(II) Complexes (1965) (53)
- Synthesis of Tetrafluorocyclobutanes by Cycloalkylation (1949) (50)
- Virtual Screening for R-Groups, including Predicted pIC50 Contributions, within Large Structural Databases, Using Topomer CoMFA (2008) (47)
- Dbtop: topomer similarity searching of conventional structure databases. (2002) (46)
- Computer-assisted synthetic analysis for complex molecules. Methods and procedures for machine generation of synthetic intermediates (1972) (44)
- AllChem: generating and searching 1020 synthetically accessible structures (2007) (43)
- Olefin Coordination Compounds of Rhodium. IV. The Mechanisms of the Synthesis of 1,4-Hexadiene from Ethylene and Butadiene and of Its Isomerization to 2,4-Hexadiene (1967) (41)
- Pushing the boundaries of 3D-QSAR (2007) (39)
- Syntheses by Free-radical Reactions. V. A New Synthesis of Carboxylic Acids (1958) (39)
- Techniques for perception by a computer of synthetically significant structural features in complex molecules (1972) (38)
- "Hydrophobic interaction" and solvation energies: discrepancies between theory and experimental data (1977) (38)
- THE SYNTHESIS OF RADIOACTIVE LACTIC ACID (1941) (38)
- Ethylene Exchange in Zeise's Anion (1965) (38)
- Bifurandione. I. Preparation and Characterization (1959) (35)
- Bis(phenylimino)sulfur (1961) (31)
- Electrophilic displacement reaction on rhodium(I) (1967) (31)
- Acetylenic Ethers. II. Ethoxy- and Butoxy-acetylene (1942) (29)
- Metabolism of lactic acid containing radioactive carboxyl carbon. (1941) (28)
- Olefin coordination compounds of rhodium. VI. Dissociative displacement of ethylene from rhodium(I) and the strength of the Rh-C2H4 bond in .pi.-C5H5Rh(C2H4)2 (1972) (28)
- Tetrafluoroethylene Complexes of Transition Metals (1965) (27)
- Rethinking 3D-QSAR (2010) (25)
- SUBSTRUCTURAL ANALYSIS, A NOVEL APPROACH TO THE PROBLEM OF DRUG DESIGN (1974) (21)
- Application of quantitative structure-activity relationships in the development of the antiallergic pyranenamines. (1979) (20)
- Synthesis of Chlorofluoropropanes (1949) (20)
- R-group template CoMFA combines benefits of “ad hoc” and topomer alignments using 3D-QSAR for lead optimization (2012) (20)
- Teaching and Learning Computational Drug Design: Student Investigations of 3D Quantitative Structure–Activity Relationships through Web Applications (2020) (19)
- Notes-New Synthesis of Aryl Fluorides and Aryl Fluorosulfonates from Oxyfluorides of Sulfur (1961) (19)
- Iminosulfur Oxydifluoride and Poly-(oxofluorosulfur nitride) (1962) (19)
- Template CoMFA: The 3D-QSAR Grail? (2014) (18)
- METABOLISM OF LACTIC ACID CONTAINING RADIOACTIVE CARBON IN THE α OR β POSITION (1942) (18)
- Solution Phase Synthesis of Chemical Libraries for Lead Discovery (1996) (16)
- Challenging the gold standard for 3D-QSAR: template CoMFA versus X-ray alignment (2014) (15)
- Template CoMFA Generates Single 3D-QSAR Models that, for Twelve of Twelve Biological Targets, Predict All ChEMBL-Tabulated Affinities (2015) (14)
- The Synthesis and Stability of Acyl Radicals; Some Reactions of Diacyl Diimides (1957) (12)
- Quantitative Series Enrichment Analysis (QSEA): a novel procedure for 3D-QSAR analysis (2008) (12)
- Acetylenic Ethers. I. Phenoxyacetylenes (1940) (10)
- Isoxazole Derivatives from Acetylene and Nitrogen Oxides (1961) (10)
- Leadhopping – and beyond (2006) (9)
- Template CoMFA Applied to 116 Biological Targets (2014) (7)
- Chapter 31: Quantitative Drug Design (1976) (6)
- Taming the combinatorial centipede (1997) (6)
- BC(DEF) Coordinates 4. Correlations with General Anesthesia, Nerve Blockade, and Erythrocyte Stabilization (1983) (6)
- Olefin-Carbon Monoxide-Alcohol Copolymers (1954) (5)
- Validating Novel QSAR Descriptors for Use in Diversity Analysis (2000) (5)
- Tautomers and topomers: challenging the uncertainties of direct physicochemical modeling (2010) (5)
- Pyranenamines: a new series of antiallergic compounds. (1979) (5)
- BC(DEF) Coordinates 3. Their Acquisition from Physical Property Data (1983) (5)
- BC(DEF) Coordinates 5. Shape-Specific vs. Orientation-Averaged Interactions of Neuroleptics and Other Centrally Acting Drugs: Correlation of Effects in Five in vitro Test Systems (1983) (4)
- Bioisosterism and molecular diversity (2002) (4)
- Design of compound libraries for detecting and pursuing novel small molecule leads (1999) (1)
- Design of a Diverse Screening Library (1998) (1)
- The Development of Antiallergic Pyranenamine Series: A QSAR Success Story (1980) (1)
- When Big Data Was Small: My Life in Baseball Analytics and Drug Design (2019) (1)
- 6 - Antiallergic and Antiulcer Agents (1983) (1)
- APPLICATION OF QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS IN THE DEVELOPMENT OF THE ANTIALLERGIC PYRANENAMINES (1979) (0)
- Oil and Gas Fields of Oklahoma, Reference Report, Volume 1 (1963) (0)
- Substructural analysis in drug design. (1976) (0)
- Difficulties with "Informer" Libraries (1998) (0)
- PYRANENAMINES: A NEW SERIES OF ANTIALLERGIC COMPOUNDS (1979) (0)
- Average Batting Skill through Major-League History (2020) (0)
- New graphically based QSAR approache (1991) (0)
- Additions and Corrections - "Hydrophobic Interaction" and Solvation Energies: Discrepancies between Theory and Experimental Data (1977) (0)
- Mechanism-based analysis of enzyme inhibitors of amide bond hydrolysis. (1989) (0)
- Pyranenamines: A New Series of Potent Antiallergic Compounds (1980) (0)
- Logic and combinational algorithms for drug design, by V. E. Golender and A. B. Rosenblit, John Wiley, New York, 289 pp. $63.95 (1984) (1985) (0)
- NEW DATA CORRELATION METHOD SCREENS DRUGS (1974) (0)
- 3D‐QSAR Approaches to De Novo Drug Design (2013) (0)
- Topomers: A Validated Protocol for Their Self‐Consistent Generation. (2004) (0)
- Call for Direction as SSHP Arrives at a Critical Crossroad (2009) (0)
- Drug-Induced Esophageal Injury: A Look at Bisphosphonates and NSAIDs (2006) (0)
- Design and preliminary results of leapfrog, a second generation DE NOVO drug discovery tool (1993) (0)
- BC(DEF) PARAMETERS. 2. AN EMPIRICAL STRUCTURE-BASED SCHEME FOR THE PREDICTION N OF SOME PHYSICAL PROPERTIES (1980) (0)
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