フォロー
Ross C Walker
Ross C Walker
所属不明
確認したメール アドレス: sdsc.edu - ホームページ
タイトル
引用先
引用先
Amber 10
DA Case, TA Darden, TE Cheatham, CL Simmerling, J Wang, RE Duke, ...
University of California, 2008
12370*2008
Amber 2023
DA Case, HM Aktulga, K Belfon, IY Ben-Shalom, JT Berryman, SR Brozell, ...
University of California, San Francisco, 2023
60282023
Routine microsecond molecular dynamics simulations with AMBER on GPUs. 2. Explicit solvent particle mesh Ewald
R Salomon-Ferrer, AW Gotz, D Poole, S Le Grand, RC Walker
Journal of chemical theory and computation 9 (9), 3878-3888, 2013
32882013
An overview of the Amber biomolecular simulation package
R Salomon‐Ferrer, DA Case, RC Walker
Wiley Interdisciplinary Reviews: Computational Molecular Science 3 (2), 198-210, 2013
26562013
Routine microsecond molecular dynamics simulations with AMBER on GPUs. 1. Generalized born
AW Gotz, MJ Williamson, D Xu, D Poole, S Le Grand, RC Walker
Journal of chemical theory and computation 8 (5), 1542-1555, 2012
20662012
Lipid14: the amber lipid force field
CJ Dickson, BD Madej, ÅA Skjevik, RM Betz, K Teigen, IR Gould, ...
Journal of chemical theory and computation 10 (2), 865-879, 2014
13202014
Long-time-step molecular dynamics through hydrogen mass repartitioning
CW Hopkins, S Le Grand, RC Walker, AE Roitberg
Journal of chemical theory and computation 11 (4), 1864-1874, 2015
11472015
SPFP: Speed without compromise—A mixed precision model for GPU accelerated molecular dynamics simulations
S Le Grand, AW Götz, RC Walker
Computer Physics Communications 184 (2), 374-380, 2013
11192013
Routine access to millisecond time scale events with accelerated molecular dynamics
LCT Pierce, R Salomon-Ferrer, C Augusto F. de Oliveira, JA McCammon, ...
Journal of chemical theory and computation 8 (9), 2997-3002, 2012
5122012
AMBER 10; University of California: San Francisco, 2008
DA Case, TA Darden, TE Cheatham III, CL Simmerling, J Wang, RE Duke, ...
Academic Search There is no corresponding record for this reference, 2008
5082008
The implementation of a fast and accurate QM/MM potential method in Amber
RC Walker, MF Crowley, DA Case
Journal of computational chemistry 29 (7), 1019-1031, 2008
4762008
Improved reweighting of accelerated molecular dynamics simulations for free energy calculation
Y Miao, W Sinko, L Pierce, D Bucher, RC Walker, JA McCammon
Journal of chemical theory and computation 10 (7), 2677-2689, 2014
4172014
GPU-accelerated molecular dynamics and free energy methods in Amber18: performance enhancements and new features
TS Lee, DS Cerutti, D Mermelstein, C Lin, S LeGrand, TJ Giese, ...
Journal of chemical information and modeling 58 (10), 2043-2050, 2018
3962018
AMBER 14; University of California: San Francisco, 2014
DA Case, V Babin, JT Berryman, RM Betz, Q Cai, DS Cerutti, ...
There is no corresponding record for this reference, 1-826, 2014
317*2014
Implementation of the SCC-DFTB method for hybrid QM/MM simulations within the Amber molecular dynamics package
GM Seabra, RC Walker, M Elstner, DA Case, AE Roitberg
The Journal of Physical Chemistry A 111 (26), 5655-5664, 2007
2782007
GAFFlipid: a General Amber Force Field for the accurate molecular dynamics simulation of phospholipid
CJ Dickson, L Rosso, RM Betz, RC Walker, IR Gould
Soft Matter 8 (37), 9617-9627, 2012
2692012
The FF14SB force field
DA Case, V Babin, JT Berryman, RM Betz, Q Cai, DS Cerutti, ...
Amber 14, 29-31, 2014
2542014
AMBER 12 University of California
DA Case, TA Darden, TE Cheatham, CL Simmerling, J Wang, RE Duke, ...
San Francisco 1 (3), 2012
2542012
LIPID11: a modular framework for lipid simulations using amber
ÅA Skjevik, BD Madej, RC Walker, K Teigen
The Journal of Physical Chemistry B 116 (36), 11124-11136, 2012
2352012
Wiley Interdiscip
R Salomon-Ferrer, DA Case, RC Walker
Rev.: Comput. Mol. Sci 3 (2), 198-210, 2013
2302013
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論文 1–20