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Journal of Computer-Aided Molecular Design
|
December 20, 2002
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection
Alexander Golbraikh, Alexander Tropsha
Combinatorial Chemistry & High Throughput Screening
|
April 23, 2002
Rational principles of compound selection for combinatorial library design
Alexander Tropsha, Weifan Zheng
Molecular Informatics
|
August 3, 2016
Using Graph Indices for the Analysis and Comparison of Chemical Datasets
Denis Fourches, Alexander Tropsha
Protein Engineering
|
January 1, 1992
Application of free energy simulations to the binding of a transition-state-analogue inhibitor to HIV protease
A Tropsha, J Hermans
Bioinformatics (Oxford, England)
|
August 13, 2003
Development of a four-body statistical pseudo-potential to discriminate native from non-native protein conformations
Bala Krishnamoorthy, Alexander Tropsha
Journal of Chemical Information and Computer Sciences
|
January 28, 2003
QSAR modeling using chirality descriptors derived from molecular topology
Alexander Golbraikh, Alexander Tropsha
Journal of Chemical Theory and Computation
|
December 3, 2015
Calculation of the Relative Binding Affinity of Enzyme Inhibitors Using the Generalized Linear Response Method
Xin Chen, Alexander Tropsha
Pharmaceutical Research
|
October 7, 2020
A Systems Biology Workflow for Drug and Vaccine Repurposing: Identifying Small-Molecule BCG Mimics to Reduce or Prevent COVID-19 Mortality
Rima Hajjo, Alexander Tropsha
Ernst Schering Foundation Symposium Proceedings
|
August 21, 2007
QSAR modeling of GPCR ligands: methodologies and examples of applications
A Tropsha, S X Wang
Journal of Medicinal Chemistry
|
March 31, 1995
Cross-validated R2-guided region selection for comparative molecular field analysis: a simple method to achieve consistent results
S J Cho, A Tropsha
Page
of 205
Search research articles
Search
Showing results (11-20 of 2,047) with videos related to
Sort By:
Page
of 205
Journal of Computer-Aided Molecular Design
|
December 20, 2002
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection
Alexander Golbraikh, Alexander Tropsha
Combinatorial Chemistry & High Throughput Screening
|
April 23, 2002
Rational principles of compound selection for combinatorial library design
Alexander Tropsha, Weifan Zheng
Molecular Informatics
|
August 3, 2016
Using Graph Indices for the Analysis and Comparison of Chemical Datasets
Denis Fourches, Alexander Tropsha
Protein Engineering
|
January 1, 1992
Application of free energy simulations to the binding of a transition-state-analogue inhibitor to HIV protease
A Tropsha, J Hermans
Bioinformatics (Oxford, England)
|
August 13, 2003
Development of a four-body statistical pseudo-potential to discriminate native from non-native protein conformations
Bala Krishnamoorthy, Alexander Tropsha
Journal of Chemical Information and Computer Sciences
|
January 28, 2003
QSAR modeling using chirality descriptors derived from molecular topology
Alexander Golbraikh, Alexander Tropsha
Journal of Chemical Theory and Computation
|
December 3, 2015
Calculation of the Relative Binding Affinity of Enzyme Inhibitors Using the Generalized Linear Response Method
Xin Chen, Alexander Tropsha
Pharmaceutical Research
|
October 7, 2020
A Systems Biology Workflow for Drug and Vaccine Repurposing: Identifying Small-Molecule BCG Mimics to Reduce or Prevent COVID-19 Mortality
Rima Hajjo, Alexander Tropsha
Ernst Schering Foundation Symposium Proceedings
|
August 21, 2007
QSAR modeling of GPCR ligands: methodologies and examples of applications
A Tropsha, S X Wang
Journal of Medicinal Chemistry
|
March 31, 1995
Cross-validated R2-guided region selection for comparative molecular field analysis: a simple method to achieve consistent results
S J Cho, A Tropsha
Page
of 205