Publications by authors named "Richard D Cramer"

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Teaching and Learning Computational Drug Design: Student Investigations of 3D Quantitative Structure-Activity Relationships through Web Applications.
Rino Ragno, Valeria Esposito, Martina Di Mario, Stefano Masiello, Marco Viscovo, Richard D Cramer

J Chem Educ· July 2020

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Template CoMFA Generates Single 3D-QSAR Models that, for Twelve of Twelve Biological Targets, Predict All ChEMBL-Tabulated Affinities.
Richard D Cramer

PLoS One· April 2016

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Challenging the gold standard for 3D-QSAR: template CoMFA versus X-ray alignment.
Bernd Wendt, Richard D Cramer

J Comput Aided Mol Des· August 2014

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Template CoMFA applied to 116 biological targets.
Richard D Cramer

J Chem Inf Model· July 2014

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Template CoMFA: the 3D-QSAR Grail?
Richard D Cramer, Bernd Wendt

J Chem Inf Model· February 2014

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R-group template CoMFA combines benefits of "ad hoc" and topomer alignments using 3D-QSAR for lead optimization.
Richard D Cramer

J Comput Aided Mol Des· July 2012

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The inevitable QSAR renaissance.
Richard D Cramer

J Comput Aided Mol Des· January 2012

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Rethinking 3D-QSAR.
Richard D Cramer

J Comput Aided Mol Des· March 2011

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Tautomers and topomers: challenging the uncertainties of direct physicochemical modeling.
Richard D Cramer

J Comput Aided Mol Des· June 2010

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Virtual screening for R-groups, including predicted pIC50 contributions, within large structural databases, using Topomer CoMFA.
Richard D Cramer, Phillip Cruz, Gunther Stahl, William C Curtiss, Brian Campbell

J Chem Inf Model· November 2008

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Quantitative Series Enrichment Analysis (QSEA): a novel procedure for 3D-QSAR analysis.
Bernd Wendt, Richard D Cramer

J Comput Aided Mol Des· August 2008

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AllChem: generating and searching 10(20) synthetically accessible structures.
Richard D Cramer, Farhad Soltanshahi, Robert Jilek, Brian Campbell

J Comput Aided Mol Des· June 2007

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Pushing the boundaries of 3D-QSAR.
Richard D Cramer, Bernd Wendt

J Comput Aided Mol Des· May 2007

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Leadhopping - and beyond.
Richard D Cramer

Expert Opin Drug Discov· September 2006

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Topomers: a validated protocol for their self-consistent generation.
Robert J Jilek, Richard D Cramer

J Chem Inf Comput Sci· December 2005

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"Lead hopping". Validation of topomer similarity as a superior predictor of similar biological activities.
Richard D Cramer, Robert J Jilek, Stefan Guessregen, Stephanie J Clark, Bernd Wendt

J Med Chem· December 2004

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Topomer CoMFA: a design methodology for rapid lead optimization.
Richard D Cramer

J Med Chem· January 2003

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Dbtop: topomer similarity searching of conventional structure databases.
Richard D Cramer, Robert J Jilek, Katherine M Andrews

J Mol Graph Model· June 2002

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