Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 6

Results: 17

Comparative exploration of hydrogen sulfide and water transmembrane free energy surfaces via orthogonal space tempering free energy sampling.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 567, doi. 10.1002/jcc.23982

By:

Lv, Chao;
Aitchison, Erick W.;
Wu, Dongsheng;
Zheng, Lianqing;
Cheng, Xiaolin;
Yang, Wei

Publication type:

Article

Coming Soon, Volume 37, Issue 6.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 543, doi. 10.1002/jcc.24065
Publication type:: Article

Table of Contents, Volume 37, Issue 6.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 546, doi. 10.1002/jcc.24066
Publication type:: Article

Editorial Board, Volume 37, Issue 6.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 545, doi. 10.1002/jcc.24067
Publication type:: Article

Copyright, Volume 37, Issue 6.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 544, doi. 10.1002/jcc.24068
Publication type:: Article

Self-guided Langevin dynamics via generalized Langevin equation.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 595, doi. 10.1002/jcc.24015

By:

Wu, Xiongwu;
Brooks, Bernard R.;
Vanden‐Eijnden, Eric

Publication type:

Article

Cover Image, Volume 37, Issue 6.

Published in:: Journal of Computational Chemistry, 2016, v. 37, n. 6, p. i, doi. 10.1002/jcc.24329
Publication type:: Article

Multiscale enhanced sampling of intrinsically disordered protein conformations.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 550, doi. 10.1002/jcc.23957

By:

Lee, Kuo Hao;
Chen, Jianhan

Publication type:

Article

Simulations of thermodynamics and kinetics on rough energy landscapes with milestoning.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 602, doi. 10.1002/jcc.24039

By:

Bello‐Rivas, Juan M.;
Elber, Ron

Publication type:

Article

Free energy simulations with the AMOEBA polarizable force field and metadynamics on GPU platform.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 614, doi. 10.1002/jcc.24227

By:

Peng, Xiangda;
Zhang, Yuebin;
Chu, Huiying;
Li, Guohui

Publication type:

Article

Accurately modeling nanosecond protein dynamics requires at least microseconds of simulation.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 558, doi. 10.1002/jcc.23973

By:

Bowman, Gregory R.

Publication type:

Article

Advanced Sampling for Molecular Simulation is Coming of Age.

Published in:

2016

By:

Yang, Wei

Publication type:

Editorial

Coupled folding and binding with 2D Window-Exchange Umbrella Sampling.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 587, doi. 10.1002/jcc.24004

By:

Dickson, Alex;
Ahlstrom, Logan S.;
Brooks, Charles L.

Publication type:

Article

Atomic-resolution dissection of the energetics and mechanism of isomerization of hydrated ATP- Mg<sup>2+</sup> through the SOMA string method.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 6, p. 575, doi. 10.1002/jcc.23991

By:

Branduardi, Davide;
Marinelli, Fabrizio;
Faraldo‐Gómez, José D.

Publication type:

Article

The Following Articles were Published in Past Issues of the Journal of Computational Chemistry.

Published in:

2016

By:

Xia, Junchao;
Flynn, William F.;
Gallicchio, Emilio;
Zhang, Bin W.;
He, Peng;
Tan, Zhiqiang;
Levy, Ronald M.

Publication type:

Other

The Following Articles were Published in Past Issues of the Journal of Computational Chemistry.

Published in:

2016

By:

Miao, Yinglong;
Feixas, Ferran;
Eun, Changsun;
McCammon, J. Andrew

Publication type:

Other

The Following Articles were Published in Past Issues of the Journal of Computational Chemistry.

Published in:

2016

By:

Galvelis, Raimondas;
Sugita, Yuji

Publication type:

Other