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Bioorganicheskaia Khimiia
|
October 1, 1985
[Structure-activity relationship in the series of muscarinic acetylcholine receptor antagonists: four types of antagonist-receptor binding]
A E Tropsha, S V Nizhniĭ, L S Iaguzhinskiĭ
Journal of Chemical Information and Computer Sciences
|
October 26, 1999
Automated pharmacophore identification for large chemical data sets
X Chen, A Rusinko, A Tropsha, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
August 15, 1993
Free energies for refolding of the common beta turn into the inverse-common beta turn: simulation of the role of D/L chirality
Y Yan, A Tropsha, J Hermans, et al.
Journal of Medicinal Chemistry
|
April 28, 2012
Chemocentric informatics approach to drug discovery: identification and experimental validation of selective estrogen receptor modulators as ligands of 5-hydroxytryptamine-6 receptors and as potential cognition enhancers
Rima Hajjo, Vincent Setola, Bryan L Roth, et al.
Proteins
|
August 18, 1999
The "random-coil" state of proteins: comparison of database statistics and molecular simulations
T M O'Connell, L Wang, A Tropsha, et al.
Journal of Chemical Information and Modeling
|
May 13, 2008
Combinatorial QSAR modeling of specificity and subtype selectivity of ligands binding to serotonin receptors 5HT1E and 5HT1F
Xiang S Wang, Hao Tang, Alexander Golbraikh, et al.
Journal of Molecular Graphics & Modelling
|
September 15, 2004
Modeling of p38 mitogen-activated protein kinase inhibitors using the Catalyst HypoGen and k-nearest neighbor QSAR methods
Zhiyan Xiao, Shikha Varma, Yun-De Xiao, et al.
Molecular Informatics
|
October 6, 2023
HIt Discovery using docking ENriched by GEnerative Modeling (HIDDEN GEM): A novel computational workflow for accelerated virtual screening of ultra-large chemical libraries
Konstantin I Popov, James Wellnitz, Travis Maxfield, et al.
Bioorganicheskaia Khimiia
|
October 1, 1985
[Structure-activity relationship in the series of muscarinic acetylcholine receptor agonists: three types of agonist-receptor complexes]
A E Tropsha, S V Nizhniĭ, L S Iaguzhinskiĭ
Pharmaceutical Research
|
May 27, 2020
Repurposing Quaternary Ammonium Compounds as Potential Treatments for COVID-19
Nancy Baker, Antony J Williams, Alexander Tropsha, et al.
Page
of 28
Search research articles
Search
Showing results (61-70 of 278) with videos related to
Sort By:
Page
of 28
Bioorganicheskaia Khimiia
|
October 1, 1985
[Structure-activity relationship in the series of muscarinic acetylcholine receptor antagonists: four types of antagonist-receptor binding]
A E Tropsha, S V Nizhniĭ, L S Iaguzhinskiĭ
Journal of Chemical Information and Computer Sciences
|
October 26, 1999
Automated pharmacophore identification for large chemical data sets
X Chen, A Rusinko, A Tropsha, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
August 15, 1993
Free energies for refolding of the common beta turn into the inverse-common beta turn: simulation of the role of D/L chirality
Y Yan, A Tropsha, J Hermans, et al.
Journal of Medicinal Chemistry
|
April 28, 2012
Chemocentric informatics approach to drug discovery: identification and experimental validation of selective estrogen receptor modulators as ligands of 5-hydroxytryptamine-6 receptors and as potential cognition enhancers
Rima Hajjo, Vincent Setola, Bryan L Roth, et al.
Proteins
|
August 18, 1999
The "random-coil" state of proteins: comparison of database statistics and molecular simulations
T M O'Connell, L Wang, A Tropsha, et al.
Journal of Chemical Information and Modeling
|
May 13, 2008
Combinatorial QSAR modeling of specificity and subtype selectivity of ligands binding to serotonin receptors 5HT1E and 5HT1F
Xiang S Wang, Hao Tang, Alexander Golbraikh, et al.
Journal of Molecular Graphics & Modelling
|
September 15, 2004
Modeling of p38 mitogen-activated protein kinase inhibitors using the Catalyst HypoGen and k-nearest neighbor QSAR methods
Zhiyan Xiao, Shikha Varma, Yun-De Xiao, et al.
Molecular Informatics
|
October 6, 2023
HIt Discovery using docking ENriched by GEnerative Modeling (HIDDEN GEM): A novel computational workflow for accelerated virtual screening of ultra-large chemical libraries
Konstantin I Popov, James Wellnitz, Travis Maxfield, et al.
Bioorganicheskaia Khimiia
|
October 1, 1985
[Structure-activity relationship in the series of muscarinic acetylcholine receptor agonists: three types of agonist-receptor complexes]
A E Tropsha, S V Nizhniĭ, L S Iaguzhinskiĭ
Pharmaceutical Research
|
May 27, 2020
Repurposing Quaternary Ammonium Compounds as Potential Treatments for COVID-19
Nancy Baker, Antony J Williams, Alexander Tropsha, et al.
Page
of 28