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Journal of Computational Chemistry
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May 5, 2011
Implementation and evaluation of a docking-rescoring method using molecular footprint comparisons
Trent E Balius, Sudipto Mukherjee, Robert C Rizzo
Journal of Chemical Information and Modeling
|
November 2, 2010
Docking validation resources: protein family and ligand flexibility experiments
Sudipto Mukherjee, Trent E Balius, Robert C Rizzo
Journal of Chemical Information and Modeling
|
September 12, 2023
Descriptor-Driven de Novo Design Algorithms for DOCK6 Using RDKit
Guilherme Duarte Ramos Matos, Steven Pak, Robert C Rizzo
Proceedings of the National Academy of Sciences of the United States of America
|
January 19, 2006
HIV-1 protease flaps spontaneously open and reclose in molecular dynamics simulations
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
Journal of the American Chemical Society
|
March 2, 2006
HIV-1 protease flaps spontaneously close to the correct structure in simulations following manual placement of an inhibitor into the open state
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
Journal of Computational Chemistry
|
October 22, 2024
Fragment and torsion biasing algorithms for construction of small organic molecules in proteins using DOCK
John D Bickel, Brock T Boysan, Robert C Rizzo
Biochemistry
|
July 6, 2018
Identification of a Water-Coordinating HER2 Inhibitor by Virtual Screening Using Similarity-Based Scoring
Jiaye Guo, Stephen Collins, W Todd Miller, et al.
Bioorganic & Medicinal Chemistry
|
December 10, 2013
Strategies for lead discovery: application of footprint similarity targeting HIVgp41
Patrick M Holden, William J Allen, Miriam Gochin, et al.
Chemical Biology & Drug Design
|
August 27, 2022
Inhibition of mutationally activated HER2
Stephen J Collins, Jiaye Guo, Robert C Rizzo, et al.
Biochemistry
|
March 17, 2010
Origins of resistance to the HIVgp41 viral entry inhibitor T20
Brian E McGillick, Trent E Balius, Sudipto Mukherjee, et al.
Page
of 7
Search research articles
Search
Showing results (11-20 of 61) with videos related to
Sort By:
Page
of 7
Journal of Computational Chemistry
|
May 5, 2011
Implementation and evaluation of a docking-rescoring method using molecular footprint comparisons
Trent E Balius, Sudipto Mukherjee, Robert C Rizzo
Journal of Chemical Information and Modeling
|
November 2, 2010
Docking validation resources: protein family and ligand flexibility experiments
Sudipto Mukherjee, Trent E Balius, Robert C Rizzo
Journal of Chemical Information and Modeling
|
September 12, 2023
Descriptor-Driven de Novo Design Algorithms for DOCK6 Using RDKit
Guilherme Duarte Ramos Matos, Steven Pak, Robert C Rizzo
Proceedings of the National Academy of Sciences of the United States of America
|
January 19, 2006
HIV-1 protease flaps spontaneously open and reclose in molecular dynamics simulations
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
Journal of the American Chemical Society
|
March 2, 2006
HIV-1 protease flaps spontaneously close to the correct structure in simulations following manual placement of an inhibitor into the open state
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
Journal of Computational Chemistry
|
October 22, 2024
Fragment and torsion biasing algorithms for construction of small organic molecules in proteins using DOCK
John D Bickel, Brock T Boysan, Robert C Rizzo
Biochemistry
|
July 6, 2018
Identification of a Water-Coordinating HER2 Inhibitor by Virtual Screening Using Similarity-Based Scoring
Jiaye Guo, Stephen Collins, W Todd Miller, et al.
Bioorganic & Medicinal Chemistry
|
December 10, 2013
Strategies for lead discovery: application of footprint similarity targeting HIVgp41
Patrick M Holden, William J Allen, Miriam Gochin, et al.
Chemical Biology & Drug Design
|
August 27, 2022
Inhibition of mutationally activated HER2
Stephen J Collins, Jiaye Guo, Robert C Rizzo, et al.
Biochemistry
|
March 17, 2010
Origins of resistance to the HIVgp41 viral entry inhibitor T20
Brian E McGillick, Trent E Balius, Sudipto Mukherjee, et al.
Page
of 7