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Alexander Tropsha

Showing results (31-40 of 248) with videos related to

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Journal of Medicinal Chemistry|April 28, 2006
Development of quantitative structure-binding affinity relationship models based on novel geometrical chemical descriptors of the protein-ligand interfacesShuxing Zhang, Alexander Golbraikh, Alexander Tropsha
Molecular Informatics|February 10, 2022
Data Mining Meets Machine Learning: A Novel ANN-based Multi-body Interaction Docking Scoring Function (MBI-score) Based on Utilizing Frequent Geometric and Chemical Patterns of Interfacial Atoms in Native Protein-ligand ComplexesRaed Khashan, Alexander Tropsha, Weifan Zheng
Pathogens (Basel, Switzerland)|July 27, 2022
Analyzing the Systems Biology Effects of COVID-19 mRNA Vaccines to Assess Their Safety and Putative Side EffectsRima Hajjo, Dima A Sabbah, Alexander Tropsha
Drug Discovery Today|March 23, 2025
The Six Ds of Exponentials and drug discovery: A path toward reversing Eroom's lawAlexander Tropsha, Holli-Joi Martin, Artem Cherkasov
Molecular Informatics|October 26, 2016
Public (Q)SAR Services, Integrated Modeling Environments, and Model Repositories on the Web: State of the Art and Perspectives for Future DevelopmentIgor V Tetko, Uko Maran, Alexander Tropsha
Proteins|May 24, 2008
HIV-1 protease function and structure studies with the simplicial neighborhood analysis of protein packing methodShuxing Zhang, Andrew H Kaplan, Alexander Tropsha
Arxiv|April 1, 2024
An Improved Metric and Benchmark for Assessing the Performance of Virtual Screening ModelsMichael Brocidiacono, Konstantin I Popov, Alexander Tropsha
Methods in Molecular Biology (Clifton, N.J.)|October 29, 2010
Application of QSAR and shape pharmacophore modeling approaches for targeted chemical library designJerry O Ebalunode, Weifan Zheng, Alexander Tropsha
Molecular Informatics|August 5, 2016
Drug Side Effect Profiles as Molecular Descriptors for Predictive Modeling of Target BioactivityNancy C Baker, Denis Fourches, Alexander Tropsha
Molecular Informatics|August 6, 2016
Comparative Analysis of QSAR-based vs. Chemical Similarity Based Predictors of GPCRs Binding AffinityMan Luo, Xiang S Wang, Alexander Tropsha
Pageof 25

Showing results (31-40 of 248) with videos related to

Sort By:
Pageof 25
Journal of Medicinal Chemistry|April 28, 2006
Development of quantitative structure-binding affinity relationship models based on novel geometrical chemical descriptors of the protein-ligand interfacesShuxing Zhang, Alexander Golbraikh, Alexander Tropsha
Molecular Informatics|February 10, 2022
Data Mining Meets Machine Learning: A Novel ANN-based Multi-body Interaction Docking Scoring Function (MBI-score) Based on Utilizing Frequent Geometric and Chemical Patterns of Interfacial Atoms in Native Protein-ligand ComplexesRaed Khashan, Alexander Tropsha, Weifan Zheng
Pathogens (Basel, Switzerland)|July 27, 2022
Analyzing the Systems Biology Effects of COVID-19 mRNA Vaccines to Assess Their Safety and Putative Side EffectsRima Hajjo, Dima A Sabbah, Alexander Tropsha
Drug Discovery Today|March 23, 2025
The Six Ds of Exponentials and drug discovery: A path toward reversing Eroom's lawAlexander Tropsha, Holli-Joi Martin, Artem Cherkasov
Molecular Informatics|October 26, 2016
Public (Q)SAR Services, Integrated Modeling Environments, and Model Repositories on the Web: State of the Art and Perspectives for Future DevelopmentIgor V Tetko, Uko Maran, Alexander Tropsha
Proteins|May 24, 2008
HIV-1 protease function and structure studies with the simplicial neighborhood analysis of protein packing methodShuxing Zhang, Andrew H Kaplan, Alexander Tropsha
Arxiv|April 1, 2024
An Improved Metric and Benchmark for Assessing the Performance of Virtual Screening ModelsMichael Brocidiacono, Konstantin I Popov, Alexander Tropsha
Methods in Molecular Biology (Clifton, N.J.)|October 29, 2010
Application of QSAR and shape pharmacophore modeling approaches for targeted chemical library designJerry O Ebalunode, Weifan Zheng, Alexander Tropsha
Molecular Informatics|August 5, 2016
Drug Side Effect Profiles as Molecular Descriptors for Predictive Modeling of Target BioactivityNancy C Baker, Denis Fourches, Alexander Tropsha
Molecular Informatics|August 6, 2016
Comparative Analysis of QSAR-based vs. Chemical Similarity Based Predictors of GPCRs Binding AffinityMan Luo, Xiang S Wang, Alexander Tropsha
Pageof 25