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Journal of Inorganic Biochemistry
|
February 2, 2010
QM/MM X-ray refinement of zinc metalloenzymes
Xue Li, Seth A Hayik, Kenneth M Merz
Biochemistry
|
October 7, 2010
Finding a needle in the haystack: computational modeling of Mg2+ binding in the active site of protein farnesyltransferase
Yue Yang, Dhruva K Chakravorty, Kenneth M Merz
Mutation Research
|
May 1, 1993
Double-strand breaks in plasmid DNA and the induction of deletions
D Schulte-Frohlinde, K H Worm, M Merz
Acta Crystallographica. Section D, Biological Crystallography
|
March 1, 2005
Refinement of protein crystal structures using energy restraints derived from linear-scaling quantum mechanics
Ning Yu, Hemant P Yennawar, Kenneth M Merz
Journal of the American Chemical Society
|
March 24, 2005
Hybrid QM/MM and DFT investigations of the catalytic mechanism and inhibition of the dinuclear zinc metallo-beta-lactamase CcrA from Bacteroides fragilis
Hwangseo Park, Edward N Brothers, Kenneth M Merz
The Journal of Physical Chemistry. A
|
August 22, 2009
Accurate benchmark calculations on the gas-phase basicities of small molecules
Xiao He, Laszlo Fusti-Molnar, Kenneth M Merz
Journal of Chemical Information and Modeling
|
March 29, 2021
AutoGraph: Autonomous Graph-Based Clustering of Small-Molecule Conformations
Kiyoto Aramis Tanemura, Susanta Das, Kenneth M Merz
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
Page
of 58
Search research articles
Search
Showing results (151-160 of 573) with videos related to
Sort By:
Page
of 58
Journal of Inorganic Biochemistry
|
February 2, 2010
QM/MM X-ray refinement of zinc metalloenzymes
Xue Li, Seth A Hayik, Kenneth M Merz
Biochemistry
|
October 7, 2010
Finding a needle in the haystack: computational modeling of Mg2+ binding in the active site of protein farnesyltransferase
Yue Yang, Dhruva K Chakravorty, Kenneth M Merz
Mutation Research
|
May 1, 1993
Double-strand breaks in plasmid DNA and the induction of deletions
D Schulte-Frohlinde, K H Worm, M Merz
Acta Crystallographica. Section D, Biological Crystallography
|
March 1, 2005
Refinement of protein crystal structures using energy restraints derived from linear-scaling quantum mechanics
Ning Yu, Hemant P Yennawar, Kenneth M Merz
Journal of the American Chemical Society
|
March 24, 2005
Hybrid QM/MM and DFT investigations of the catalytic mechanism and inhibition of the dinuclear zinc metallo-beta-lactamase CcrA from Bacteroides fragilis
Hwangseo Park, Edward N Brothers, Kenneth M Merz
The Journal of Physical Chemistry. A
|
August 22, 2009
Accurate benchmark calculations on the gas-phase basicities of small molecules
Xiao He, Laszlo Fusti-Molnar, Kenneth M Merz
Journal of Chemical Information and Modeling
|
March 29, 2021
AutoGraph: Autonomous Graph-Based Clustering of Small-Molecule Conformations
Kiyoto Aramis Tanemura, Susanta Das, Kenneth M Merz
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
Page
of 58