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Drug Discovery Today
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September 3, 2013
Fragment-based error estimation in biomolecular modeling
John C Faver, 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
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
Physical Chemistry Chemical Physics : PCCP
|
March 2, 2012
Statistics-based model for basis set superposition error correction in large biomolecules
John C Faver, Zheng Zheng, Kenneth M Merz
ACS Medicinal Chemistry Letters
|
December 7, 2013
Computer-aided Drug Design: Using Numbers to your Advantage
John C Faver, M Nihan Ucisik, Wei Yang, et al.
Journal of Chemical Theory and Computation
|
May 8, 2014
Bringing Clarity to the Prediction of Protein-Ligand Binding Free Energies via "Blurring"
Melek N Ucisik, Zheng Zheng, John C Faver, et al.
The Journal of Chemical Physics
|
September 8, 2011
Pairwise additivity of energy components in protein-ligand binding: the HIV II protease-Indinavir case
Melek N Ucisik, Danial S Dashti, John C Faver, et al.
Journal of Computer-Aided Molecular Design
|
April 6, 2012
Prediction of trypsin/molecular fragment binding affinities by free energy decomposition and empirical scores
Mark L Benson, John C Faver, Melek N Ucisik, et al.
Organic Letters
|
March 13, 2019
A Mild, DNA-Compatible Nitro Reduction Using B<sub>2</sub>(OH)<sub>4</sub>
Huang-Chi Du, Nicholas Simmons, John C Faver, et al.
ACS Combinatorial Science
|
January 24, 2019
Quantitative Comparison of Enrichment from DNA-Encoded Chemical Library Selections
John C Faver, Kevin Riehle, David R Lancia, et al.
Page
of 3
Search research articles
Search
Showing results (1-10 of 26) with videos related to
Sort By:
Page
of 3
Drug Discovery Today
|
September 3, 2013
Fragment-based error estimation in biomolecular modeling
John C Faver, 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
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
Physical Chemistry Chemical Physics : PCCP
|
March 2, 2012
Statistics-based model for basis set superposition error correction in large biomolecules
John C Faver, Zheng Zheng, Kenneth M Merz
ACS Medicinal Chemistry Letters
|
December 7, 2013
Computer-aided Drug Design: Using Numbers to your Advantage
John C Faver, M Nihan Ucisik, Wei Yang, et al.
Journal of Chemical Theory and Computation
|
May 8, 2014
Bringing Clarity to the Prediction of Protein-Ligand Binding Free Energies via "Blurring"
Melek N Ucisik, Zheng Zheng, John C Faver, et al.
The Journal of Chemical Physics
|
September 8, 2011
Pairwise additivity of energy components in protein-ligand binding: the HIV II protease-Indinavir case
Melek N Ucisik, Danial S Dashti, John C Faver, et al.
Journal of Computer-Aided Molecular Design
|
April 6, 2012
Prediction of trypsin/molecular fragment binding affinities by free energy decomposition and empirical scores
Mark L Benson, John C Faver, Melek N Ucisik, et al.
Organic Letters
|
March 13, 2019
A Mild, DNA-Compatible Nitro Reduction Using B<sub>2</sub>(OH)<sub>4</sub>
Huang-Chi Du, Nicholas Simmons, John C Faver, et al.
ACS Combinatorial Science
|
January 24, 2019
Quantitative Comparison of Enrichment from DNA-Encoded Chemical Library Selections
John C Faver, Kevin Riehle, David R Lancia, et al.
Page
of 3