Search research articles
Contact Us
Filters
Showing results (11-20 of 36) with videos related to
Page
of 4
Sort By:
Journal of Molecular Modeling
|
May 10, 2014
Probing the global and local dynamics of aminoacyl-tRNA synthetases using all-atom and coarse-grained simulations
Alexander M Strom, Samuel C Fehling, Sudeep Bhattacharyya, et al.
The Journal of Physical Chemistry. A
|
June 15, 2007
Combined quantum mechanical and molecular mechanical simulations of one- and two-electron reduction potentials of flavin cofactor in water, medium-chain acyl-CoA dehydrogenase, and cholesterol oxidase
Sudeep Bhattacharyya, Marian T Stankovich, Donald G Truhlar, et al.
The Journal of Physical Chemistry. B
|
March 18, 2011
Interplay of flavin's redox states and protein dynamics: an insight from QM/MM simulations of dihydronicotinamide riboside quinone oxidoreductase 2
Robyn M Mueller, Michael A North, Chee Yang, et al.
Biochemistry
|
December 14, 2005
Potential of mean force calculation for the proton and hydride transfer reactions catalyzed by medium-chain acyl-CoA dehydrogenase: effect of mutations on enzyme catalysis
Sudeep Bhattacharyya, Shuhua Ma, Marian T Stankovich, et al.
Inorganic Chemistry
|
April 30, 2002
Synthesis, characterization, and reactivity of mononuclear O,N-chelated vanadium(IV) and -(III) complexes of methyl 2-Aminocyclopent-1-ene-1-dithiocarboxylate based ligand: reporting an example of conformational isomerism in the solid state
Sudeep Bhattacharyya, Suman Mukhopadhyay, Satyabrata Samanta, et al.
ACS Catalysis
|
October 5, 2019
Cyclic Changes in Active Site Polarization and Dynamics Drive the 'Ping-pong' Kinetics in NRH:Quinone Oxidoreductase 2: An Insight from QM/MM Simulations
Clorice R Reinhardt, Quin H Hu, Caitlin G Bresnahan, et al.
The Journal of Biological Chemistry
|
February 4, 2009
Evolutionary basis for the coupled-domain motions in Thermus thermophilus leucyl-tRNA synthetase
Kristina Mary Ellen Weimer, Brianne Leigh Shane, Michael Brunetto, et al.
Journal of Chemical Information and Modeling
|
July 17, 2025
Graph Convolutional Neural Network-Enabled Frontier Molecular Orbital Prediction: A Case Study with Neurotransmitters and Antidepressants
Rivaaj Monsia, Stewart C Gundry, Molly L Mohr, et al.
Biophysical Journal
|
September 23, 2019
Crowder-Induced Conformational Ensemble Shift in Escherichia coli Prolyl-tRNA Synthetase
Lauren M Adams, Ryan J Andrews, Quin H Hu, et al.
Journal of the American Chemical Society
|
February 10, 2009
Critical role of substrate conformational change in the proton transfer process catalyzed by 4-oxalocrotonate tautomerase
J Javier Ruiz-Pernía, Mireia Garcia-Viloca, Sudeep Bhattacharyya, et al.
Page
of 4
Search research articles
Search
Showing results (11-20 of 36) with videos related to
Sort By:
Page
of 4
Journal of Molecular Modeling
|
May 10, 2014
Probing the global and local dynamics of aminoacyl-tRNA synthetases using all-atom and coarse-grained simulations
Alexander M Strom, Samuel C Fehling, Sudeep Bhattacharyya, et al.
The Journal of Physical Chemistry. A
|
June 15, 2007
Combined quantum mechanical and molecular mechanical simulations of one- and two-electron reduction potentials of flavin cofactor in water, medium-chain acyl-CoA dehydrogenase, and cholesterol oxidase
Sudeep Bhattacharyya, Marian T Stankovich, Donald G Truhlar, et al.
The Journal of Physical Chemistry. B
|
March 18, 2011
Interplay of flavin's redox states and protein dynamics: an insight from QM/MM simulations of dihydronicotinamide riboside quinone oxidoreductase 2
Robyn M Mueller, Michael A North, Chee Yang, et al.
Biochemistry
|
December 14, 2005
Potential of mean force calculation for the proton and hydride transfer reactions catalyzed by medium-chain acyl-CoA dehydrogenase: effect of mutations on enzyme catalysis
Sudeep Bhattacharyya, Shuhua Ma, Marian T Stankovich, et al.
Inorganic Chemistry
|
April 30, 2002
Synthesis, characterization, and reactivity of mononuclear O,N-chelated vanadium(IV) and -(III) complexes of methyl 2-Aminocyclopent-1-ene-1-dithiocarboxylate based ligand: reporting an example of conformational isomerism in the solid state
Sudeep Bhattacharyya, Suman Mukhopadhyay, Satyabrata Samanta, et al.
ACS Catalysis
|
October 5, 2019
Cyclic Changes in Active Site Polarization and Dynamics Drive the 'Ping-pong' Kinetics in NRH:Quinone Oxidoreductase 2: An Insight from QM/MM Simulations
Clorice R Reinhardt, Quin H Hu, Caitlin G Bresnahan, et al.
The Journal of Biological Chemistry
|
February 4, 2009
Evolutionary basis for the coupled-domain motions in Thermus thermophilus leucyl-tRNA synthetase
Kristina Mary Ellen Weimer, Brianne Leigh Shane, Michael Brunetto, et al.
Journal of Chemical Information and Modeling
|
July 17, 2025
Graph Convolutional Neural Network-Enabled Frontier Molecular Orbital Prediction: A Case Study with Neurotransmitters and Antidepressants
Rivaaj Monsia, Stewart C Gundry, Molly L Mohr, et al.
Biophysical Journal
|
September 23, 2019
Crowder-Induced Conformational Ensemble Shift in Escherichia coli Prolyl-tRNA Synthetase
Lauren M Adams, Ryan J Andrews, Quin H Hu, et al.
Journal of the American Chemical Society
|
February 10, 2009
Critical role of substrate conformational change in the proton transfer process catalyzed by 4-oxalocrotonate tautomerase
J Javier Ruiz-Pernía, Mireia Garcia-Viloca, Sudeep Bhattacharyya, et al.
Page
of 4