标题
Parallel algorithms for hyperdynamics and local hyperdynamics
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 153, Issue 5, Pages 054116
出版商
AIP Publishing
发表日期
2020-08-05
DOI
10.1063/5.0014448
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- gen.parRep: A first implementation of the Generalized Parallel Replica dynamics for the long time simulation of metastable biochemical systems
- (2019) Florent Hédin et al. COMPUTER PHYSICS COMMUNICATIONS
- Multiply accelerated ReaxFF molecular dynamics: coupling parallel replica dynamics with collective variable hyper dynamics
- (2019) Karthik Ganeshan et al. MOLECULAR SIMULATION
- Markov State Models: From an Art to a Science
- (2018) Brooke E. Husic et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Accelerated molecular dynamics simulations for characterizing plastic deformation in crystalline materials with cracks
- (2016) Subhendu Chakraborty et al. COMPUTATIONAL MATERIALS SCIENCE
- Multiscale diffusion method for simulations of long-time defect evolution with application to dislocation climb
- (2016) K.L. Baker et al. JOURNAL OF THE MECHANICS AND PHYSICS OF SOLIDS
- The parallel replica dynamics method – Coming of age
- (2015) Danny Perez et al. COMPUTATIONAL MATERIALS SCIENCE
- Hyperdynamics boost factor achievable with an ideal bias potential
- (2015) Chen Huang et al. JOURNAL OF CHEMICAL PHYSICS
- Long-Time Dynamics through Parallel Trajectory Splicing
- (2015) Danny Perez et al. Journal of Chemical Theory and Computation
- Markov state models of biomolecular conformational dynamics
- (2014) John D Chodera et al. CURRENT OPINION IN STRUCTURAL BIOLOGY
- Extending atomistic simulation timescale in solid/liquid systems: Crystal growth from solution by a parallel-replica dynamics and continuum hybrid method
- (2014) Chun-Yaung Lu et al. JOURNAL OF CHEMICAL PHYSICS
- Adaptive Accelerated ReaxFF Reactive Dynamics with Validation from Simulating Hydrogen Combustion
- (2014) Tao Cheng et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Local hyperdynamics
- (2013) Soo Young Kim et al. JOURNAL OF CHEMICAL PHYSICS
- Accelerated molecular dynamics simulation of low-velocity frictional sliding
- (2010) W K Kim et al. MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING
- Large-scale conformational sampling of proteins using temperature-accelerated molecular dynamics
- (2010) C. F. Abrams et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool
- (2009) Alexander Stukowski MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING
- Accelerated Molecular Dynamics of Temperature-Programed Desorption
- (2009) Kelly E. Becker et al. PHYSICAL REVIEW LETTERS
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