Towards polarizable molecular dynamics simulations on biologically meaningful timescales: matching additive and polarizable force fields for multiscale simulation

被引：0

作者：

Baker, C. ^{[1
]}

机构：

[1] Univ Cambridge, Cambridge, England

来源：

FEBS JOURNAL | 2012年 / 279卷

关键词：

D O I：

暂无

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

引用

页码：531 / 531

页数：1

共 50 条

[1] Matching of Additive and Polarizable Force Fields for Multiscale Condensed Phase Simulations
Baker, Christopher M.
Best, Robert B.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2013, 9 (06) : 2826 - 2837
[2] Polarizable force fields for molecular dynamics simulations of biomolecules
Baker, Christopher M.
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE, 2015, 5 (02) : 241 - 254
[3] Pairwise-additive and polarizable atomistic force fields for molecular dynamics simulations of proteins
Lemkul, Justin A.
COMPUTATIONAL APPROACHES FOR UNDERSTANDING DYNAMICAL SYSTEMS: PROTEIN FOLDING AND ASSEMBLY, 2020, 170 : 1 - 71
[4] Polarizable force fields for Monte Carlo and molecular dynamics simulations
Jordan, Kenneth D.
DeFusco, Albert A., III
Jiang, Hao
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2006, 232 : 922 - 922
[5] Molecular dynamics simulation of HIV-protease with polarizable and non-polarizable force fields
Meher, B. R.
Kumar, M. V. Satish
Bandyopadhyay, Pradipta
INDIAN JOURNAL OF PHYSICS, 2009, 83 (01) : 81 - 90
[6] Molecular dynamics simulation of HIV-protease with polarizable and non-polarizable force fields
B. R. Meher
M. V. Satish Kumar
Pradipta Bandyopadhyay
Indian Journal of Physics, 2009, 83 : 81 - 90
[7] A Scalable and Efficient Approach to Polarizable Force Fields in Molecular Dynamics Simulations
Coles, Jonathan P.
Masella, Michel
BIOPHYSICAL JOURNAL, 2018, 114 (03) : 675A - 675A
[8] Molecular dynamics simulations of methane hydrate using polarizable force fields
Jiang, Hao
Jordan, Kenneth D.
Taylor, Charles
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2007, 233
[9] Molecular dynamics simulations of methane hydrate using polarizable force fields
Jiang, H.
Jordan, K. D.
Taylor, C. E.
JOURNAL OF PHYSICAL CHEMISTRY B, 2007, 111 (23): : 6486 - 6492
[10] DLPGEN: Preparing Molecular Dynamics Simulations with Support for Polarizable Force Fields
Bernardes, Carlos E. S.
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2022, 62 (06) : 1471 - 1478

← 1 2 3 4 5 →