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Molecular Informatics
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July 28, 2016
Best Practices for QSAR Model Development, Validation, and Exploitation
Alexander Tropsha
Pacific Symposium on Biocomputing. Pacific Symposium on Biocomputing
|
July 21, 2000
Computer-aided combinatorial chemistry and cheminformatics
Tropsha, Pearlman
Experientia Supplementum (2012)
|
September 5, 2012
Recent trends in statistical QSAR modeling of environmental chemical toxicity
Alexander Tropsha
Journal of Chemical Information and Computer Sciences
|
February 8, 2000
Novel variable selection quantitative structure--property relationship approach based on the k-nearest-neighbor principle
Zheng, Tropsha
Current Opinion in Drug Discovery & Development
|
August 4, 2009
Recent trends in computer-aided drug discovery
A Tropsha
Journal of Chemical Information and Modeling
|
June 1, 2005
kappa Nearest neighbors QSAR modeling as a variational problem: theory and applications
Peter Itskowitz, Alexander Tropsha
Current Pharmaceutical Design
|
January 29, 2008
Predictive QSAR modeling workflow, model applicability domains, and virtual screening
Alexander Tropsha, Alexander Golbraikh
Current Pharmaceutical Design
|
May 29, 2001
Identification of the descriptor pharmacophores using variable selection QSAR: applications to database mining
A Tropsha, W Zheng
Molecular Diversity
|
January 29, 2003
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection
Alexander Golbraikh, Alexander Tropsha
Journal of Medicinal Chemistry
|
January 6, 1995
Relative binding free energies of peptide inhibitors of HIV-1 protease: the influence of the active site protonation state
X Chen, A Tropsha
Page
of 31
Search research articles
Search
Showing results (1-10 of 302) with videos related to
Sort By:
Page
of 31
Molecular Informatics
|
July 28, 2016
Best Practices for QSAR Model Development, Validation, and Exploitation
Alexander Tropsha
Pacific Symposium on Biocomputing. Pacific Symposium on Biocomputing
|
July 21, 2000
Computer-aided combinatorial chemistry and cheminformatics
Tropsha, Pearlman
Experientia Supplementum (2012)
|
September 5, 2012
Recent trends in statistical QSAR modeling of environmental chemical toxicity
Alexander Tropsha
Journal of Chemical Information and Computer Sciences
|
February 8, 2000
Novel variable selection quantitative structure--property relationship approach based on the k-nearest-neighbor principle
Zheng, Tropsha
Current Opinion in Drug Discovery & Development
|
August 4, 2009
Recent trends in computer-aided drug discovery
A Tropsha
Journal of Chemical Information and Modeling
|
June 1, 2005
kappa Nearest neighbors QSAR modeling as a variational problem: theory and applications
Peter Itskowitz, Alexander Tropsha
Current Pharmaceutical Design
|
January 29, 2008
Predictive QSAR modeling workflow, model applicability domains, and virtual screening
Alexander Tropsha, Alexander Golbraikh
Current Pharmaceutical Design
|
May 29, 2001
Identification of the descriptor pharmacophores using variable selection QSAR: applications to database mining
A Tropsha, W Zheng
Molecular Diversity
|
January 29, 2003
Predictive QSAR modeling based on diversity sampling of experimental datasets for the training and test set selection
Alexander Golbraikh, Alexander Tropsha
Journal of Medicinal Chemistry
|
January 6, 1995
Relative binding free energies of peptide inhibitors of HIV-1 protease: the influence of the active site protonation state
X Chen, A Tropsha
Page
of 31