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July 31, 2020
Refinement of pairwise potentials via logistic regression to score protein-protein interactions
Kiyoto A Tanemura, Jun Pei, Kenneth M Merz
The Journal of Chemical Physics
|
October 21, 2011
Model for the fast estimation of basis set superposition error in biomolecular systems
John C Faver, Zheng Zheng, Kenneth M Merz
The Journal of Physical Chemistry. B
|
August 23, 2014
Parameterization of highly charged metal ions using the 12-6-4 LJ-type nonbonded model in explicit water
Pengfei Li, Lin Frank Song, Kenneth M Merz
Biochemistry
|
September 5, 2014
Origin of product selectivity in a prenyl transfer reaction from the same intermediate: exploration of multiple FtmPT1-catalyzed prenyl transfer pathways
Li-Li Pan, Yue Yang, Kenneth M Merz
Journal of Chemical Information and Modeling
|
February 4, 2022
Effect of an Inhibitor on the ACE2-Receptor-Binding Domain of SARS-CoV-2
Gaurav Sharma, Lin Frank Song, Kenneth M Merz
Journal of Chemical Information and Modeling
|
April 8, 2024
Editorial: Machine Learning in Bio-cheminformatics
Kenneth M Merz, Guo-Wei Wei, Feng Zhu
Journal of Chemical Information and Modeling
|
January 9, 2023
Editorial: Machine Learning in Bio-cheminformatics
Kenneth M Merz, Guo-Wei Wei, Feng Zhu
Journal of Chemical Theory and Computation
|
January 12, 2011
A Mixed QM/MM Scoring Function to Predict Protein-Ligand Binding Affinity
Seth A Hayik, Roland Dunbrack, Kenneth M Merz
Journal of Chemical Theory and Computation
|
December 4, 2015
A Combined QM/MM Poisson-Boltzmann Approach
Seth A Hayik, Ning Liao, Kenneth M Merz
Journal of Chemical Theory and Computation
|
February 16, 2013
The Effects of Computational Modeling Errors on the Estimation of Statistical Mechanical Variables
John C Faver, Wei Yang, Kenneth M Merz
Page
of 34
Search research articles
Search
Showing results (101-110 of 332) with videos related to
Sort By:
Page
of 34
Proteins
|
July 31, 2020
Refinement of pairwise potentials via logistic regression to score protein-protein interactions
Kiyoto A Tanemura, Jun Pei, Kenneth M Merz
The Journal of Chemical Physics
|
October 21, 2011
Model for the fast estimation of basis set superposition error in biomolecular systems
John C Faver, Zheng Zheng, Kenneth M Merz
The Journal of Physical Chemistry. B
|
August 23, 2014
Parameterization of highly charged metal ions using the 12-6-4 LJ-type nonbonded model in explicit water
Pengfei Li, Lin Frank Song, Kenneth M Merz
Biochemistry
|
September 5, 2014
Origin of product selectivity in a prenyl transfer reaction from the same intermediate: exploration of multiple FtmPT1-catalyzed prenyl transfer pathways
Li-Li Pan, Yue Yang, Kenneth M Merz
Journal of Chemical Information and Modeling
|
February 4, 2022
Effect of an Inhibitor on the ACE2-Receptor-Binding Domain of SARS-CoV-2
Gaurav Sharma, Lin Frank Song, Kenneth M Merz
Journal of Chemical Information and Modeling
|
April 8, 2024
Editorial: Machine Learning in Bio-cheminformatics
Kenneth M Merz, Guo-Wei Wei, Feng Zhu
Journal of Chemical Information and Modeling
|
January 9, 2023
Editorial: Machine Learning in Bio-cheminformatics
Kenneth M Merz, Guo-Wei Wei, Feng Zhu
Journal of Chemical Theory and Computation
|
January 12, 2011
A Mixed QM/MM Scoring Function to Predict Protein-Ligand Binding Affinity
Seth A Hayik, Roland Dunbrack, Kenneth M Merz
Journal of Chemical Theory and Computation
|
December 4, 2015
A Combined QM/MM Poisson-Boltzmann Approach
Seth A Hayik, Ning Liao, Kenneth M Merz
Journal of Chemical Theory and Computation
|
February 16, 2013
The Effects of Computational Modeling Errors on the Estimation of Statistical Mechanical Variables
John C Faver, Wei Yang, Kenneth M Merz
Page
of 34