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Alexander Tropsha

Showing results (21-30 of 248) with videos related to

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Proteins|May 15, 2012
Scoring protein interaction decoys using exposed residues (SPIDER): a novel multibody interaction scoring function based on frequent geometric patterns of interfacial residuesRaed Khashan, Weifan Zheng, Alexander Tropsha
Nature Chemical Biology|July 22, 2015
Curation of chemogenomics dataDenis Fourches, Eugene Muratov, Alexander Tropsha
Combinatorial Chemistry & High Throughput Screening|February 1, 2011
Exploring quantitative nanostructure-activity relationships (QNAR) modeling as a tool for predicting biological effects of manufactured nanoparticlesDenis Fourches, Dongqiuye Pu, Alexander Tropsha
Toxicology and Applied Pharmacology|July 25, 2014
Prediction of binding affinity and efficacy of thyroid hormone receptor ligands using QSAR and structure-based modeling methodsRegina Politi, Ivan Rusyn, Alexander Tropsha
Journal of Chemical Information and Computer Sciences|July 23, 2002
Novel ZE-isomerism descriptors derived from molecular topology and their application to QSAR analysisAlexander Golbraikh, Danail Bonchev, Alexander Tropsha
Journal of Chemical Information and Modeling|December 19, 2014
Target-specific native/decoy pose classifier improves the accuracy of ligand ranking in the CSAR 2013 benchmarkDenis Fourches, Regina Politi, Alexander Tropsha
Science Advances|July 28, 2018
Deep reinforcement learning for de novo drug designMariya Popova, Olexandr Isayev, Alexander Tropsha
Journal of Chemical Information and Modeling|June 25, 2010
Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling researchDenis Fourches, Eugene Muratov, Alexander Tropsha
Molecular Informatics|August 4, 2016
The Development of Novel Chemical Fragment-Based Descriptors Using Frequent Common Subgraph Mining Approach and Their Application in QSAR ModelingRaed Khashan, Weifan Zheng, Alexander Tropsha
Journal of Chemical Information and Modeling|June 10, 2016
Trust, but Verify II: A Practical Guide to Chemogenomics Data CurationDenis Fourches, Eugene Muratov, Alexander Tropsha
Pageof 25

Showing results (21-30 of 248) with videos related to

Sort By:
Pageof 25
Proteins|May 15, 2012
Scoring protein interaction decoys using exposed residues (SPIDER): a novel multibody interaction scoring function based on frequent geometric patterns of interfacial residuesRaed Khashan, Weifan Zheng, Alexander Tropsha
Nature Chemical Biology|July 22, 2015
Curation of chemogenomics dataDenis Fourches, Eugene Muratov, Alexander Tropsha
Combinatorial Chemistry & High Throughput Screening|February 1, 2011
Exploring quantitative nanostructure-activity relationships (QNAR) modeling as a tool for predicting biological effects of manufactured nanoparticlesDenis Fourches, Dongqiuye Pu, Alexander Tropsha
Toxicology and Applied Pharmacology|July 25, 2014
Prediction of binding affinity and efficacy of thyroid hormone receptor ligands using QSAR and structure-based modeling methodsRegina Politi, Ivan Rusyn, Alexander Tropsha
Journal of Chemical Information and Computer Sciences|July 23, 2002
Novel ZE-isomerism descriptors derived from molecular topology and their application to QSAR analysisAlexander Golbraikh, Danail Bonchev, Alexander Tropsha
Journal of Chemical Information and Modeling|December 19, 2014
Target-specific native/decoy pose classifier improves the accuracy of ligand ranking in the CSAR 2013 benchmarkDenis Fourches, Regina Politi, Alexander Tropsha
Science Advances|July 28, 2018
Deep reinforcement learning for de novo drug designMariya Popova, Olexandr Isayev, Alexander Tropsha
Journal of Chemical Information and Modeling|June 25, 2010
Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling researchDenis Fourches, Eugene Muratov, Alexander Tropsha
Molecular Informatics|August 4, 2016
The Development of Novel Chemical Fragment-Based Descriptors Using Frequent Common Subgraph Mining Approach and Their Application in QSAR ModelingRaed Khashan, Weifan Zheng, Alexander Tropsha
Journal of Chemical Information and Modeling|June 10, 2016
Trust, but Verify II: A Practical Guide to Chemogenomics Data CurationDenis Fourches, Eugene Muratov, Alexander Tropsha
Pageof 25