An MPI Parallel Implementation of Newmark's Method

2000 ◽  
Vol 15 (3) ◽  
pp. 189-195 ◽  
Author(s):  
Ali Namazifard ◽  
I. D. Parsons
Keyword(s):  
Parallel Implementation ◽  
Newmark’S Method

Massively Parallel Implementation of Steered Molecular Dynamics in Tinker-HP: Comparisons of Polarizable and Non-Polarizable Simulations of Realistic Systems

2019 ◽  
Author(s):  
Frédéric Célerse ◽  
Louis Lagardere ◽  
Étienne Derat ◽  
Jean-Philip Piquemal
Keyword(s):  
Molecular Dynamics ◽  
Parallel Implementation ◽  
Steered Molecular Dynamics ◽  
Massively Parallel

This paper is dedicated to the massively parallel implementation of Steered Molecular Dynamics in the Tinker-HP softwtare. It allows for direct comparisons of polarizable and non-polarizable simulations of realistic systems.

Massively Parallel Implementation of Steered Molecular Dynamics in Tinker-HP: Comparisons of Polarizable and Non-Polarizable Simulations of Realistic Systems

2019 ◽  
Author(s):  
Frédéric Célerse ◽  
Louis Lagardere ◽  
Étienne Derat ◽  
Jean-Philip Piquemal
Keyword(s):  
Molecular Dynamics ◽  
Parallel Implementation ◽  
Steered Molecular Dynamics ◽  
Massively Parallel

This paper is dedicated to the massively parallel implementation of Steered Molecular Dynamics in the Tinker-HP softwtare. It allows for direct comparisons of polarizable and non-polarizable simulations of realistic systems.

CUDA-based parallel implementation of fast moment invariants algorithm

2010 ◽  
Vol 30 (7) ◽  
pp. 1983-1986
Author(s):  
Bin HAN ◽  
Wen-yun SUN ◽  
Fei ZHOU ◽  
Shi-tong WANG
Keyword(s):  
Parallel Implementation ◽  
Moment Invariants
Sign in / Sign up

Export Citation Format

Share Document