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The Journal of Chemical Physics
|
May 3, 2018
Kinetic energy definition in velocity Verlet integration for accurate pressure evaluation
Jaewoon Jung, Chigusa Kobayashi, Yuji Sugita
The Journal of Chemical Physics
|
March 3, 2010
Møller-Plesset perturbation theory gradient in the generalized hybrid orbital quantum mechanical and molecular mechanical method
Jaewoon Jung, Yuji Sugita, S Ten-no
Physical Chemistry Chemical Physics : PCCP
|
July 16, 2011
QM/MM calculation of protein magnetic shielding tensors with generalized hybrid-orbital method: a GIAO approach
Yoshinobu Akinaga, Jaewoon Jung, Seiichiro Ten-no
Proteins
|
November 24, 2004
Topological determinants of protein unfolding rates
Jaewoon Jung, Jooyoung Lee, Hie-Tae Moon
Journal of Chemical Theory and Computation
|
September 16, 2016
Graphics Processing Unit Acceleration and Parallelization of GENESIS for Large-Scale Molecular Dynamics Simulations
Jaewoon Jung, Akira Naurse, Chigusa Kobayashi, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
October 1, 2021
Structural and energetic analysis of metastable intermediate states in the E1P-E2P transition of Ca<sup>2+</sup>-ATPase
Chigusa Kobayashi, Yasuhiro Matsunaga, Jaewoon Jung, et al.
The Journal of Chemical Physics
|
August 6, 2020
A singularity-free torsion angle potential for coarse-grained molecular dynamics simulations
Cheng Tan, Jaewoon Jung, Chigusa Kobayashi, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 21, 2011
A combined quantum mechanical and molecular mechanical method using modified generalized hybrid orbitals: implementation for electronic excited states
Yukio Kawashima, Haruyuki Nakano, Jaewoon Jung, et al.
The Journal of Chemical Physics
|
February 8, 2013
Improved constrained optimization method for reaction-path determination in the generalized hybrid orbital quantum mechanical/molecular mechanical calculations
Jaewoon Jung, Suyong Re, Yuji Sugita, et al.
Journal of Computational Chemistry
|
July 24, 2010
Geometrically associative yet electronically dissociative character in the transition state of enzymatic reversible phosphorylation
Suyong Re, Takashi Imai, Jaewoon Jung, et al.
Page
of 5
Search research articles
Search
Showing results (11-20 of 43) with videos related to
Sort By:
Page
of 5
The Journal of Chemical Physics
|
May 3, 2018
Kinetic energy definition in velocity Verlet integration for accurate pressure evaluation
Jaewoon Jung, Chigusa Kobayashi, Yuji Sugita
The Journal of Chemical Physics
|
March 3, 2010
Møller-Plesset perturbation theory gradient in the generalized hybrid orbital quantum mechanical and molecular mechanical method
Jaewoon Jung, Yuji Sugita, S Ten-no
Physical Chemistry Chemical Physics : PCCP
|
July 16, 2011
QM/MM calculation of protein magnetic shielding tensors with generalized hybrid-orbital method: a GIAO approach
Yoshinobu Akinaga, Jaewoon Jung, Seiichiro Ten-no
Proteins
|
November 24, 2004
Topological determinants of protein unfolding rates
Jaewoon Jung, Jooyoung Lee, Hie-Tae Moon
Journal of Chemical Theory and Computation
|
September 16, 2016
Graphics Processing Unit Acceleration and Parallelization of GENESIS for Large-Scale Molecular Dynamics Simulations
Jaewoon Jung, Akira Naurse, Chigusa Kobayashi, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
October 1, 2021
Structural and energetic analysis of metastable intermediate states in the E1P-E2P transition of Ca<sup>2+</sup>-ATPase
Chigusa Kobayashi, Yasuhiro Matsunaga, Jaewoon Jung, et al.
The Journal of Chemical Physics
|
August 6, 2020
A singularity-free torsion angle potential for coarse-grained molecular dynamics simulations
Cheng Tan, Jaewoon Jung, Chigusa Kobayashi, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 21, 2011
A combined quantum mechanical and molecular mechanical method using modified generalized hybrid orbitals: implementation for electronic excited states
Yukio Kawashima, Haruyuki Nakano, Jaewoon Jung, et al.
The Journal of Chemical Physics
|
February 8, 2013
Improved constrained optimization method for reaction-path determination in the generalized hybrid orbital quantum mechanical/molecular mechanical calculations
Jaewoon Jung, Suyong Re, Yuji Sugita, et al.
Journal of Computational Chemistry
|
July 24, 2010
Geometrically associative yet electronically dissociative character in the transition state of enzymatic reversible phosphorylation
Suyong Re, Takashi Imai, Jaewoon Jung, et al.
Page
of 5