Electrostatic calculations and multiple time scales in molecular dynamics simulation of flexible molecular systems

1998 ◽  
Vol 108 (21) ◽  
pp. 8799-8803 ◽  
Author(s):  
Piero Procacci ◽  
Massimo Marchi ◽  
Glenn J. Martyna
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Time Scales ◽  
Dynamics Simulation ◽  
Multiple Time Scales ◽  
Multiple Time ◽  
Molecular Systems ◽  
Electrostatic Calculations

scholarly journals Molecular Dynamics with Multiple Time Scales: How to Avoid Pitfalls

2010 ◽  
Vol 6 (6) ◽  
pp. 1798-1804 ◽  
Author(s):  
Joseph A. Morrone ◽  
Ruhong Zhou ◽  
B. J. Berne
Keyword(s):  
Molecular Dynamics ◽  
Time Scales ◽  
Multiple Time Scales ◽  
Multiple Time

Molecular dynamics algorithm for multiple time scales: Systems with long range forces

1991 ◽  
Vol 94 (10) ◽  
pp. 6811-6815 ◽  
Author(s):  
Mark E. Tuckerman ◽  
Bruce J. Berne ◽  
Glenn J. Martyna
Keyword(s):  
Molecular Dynamics ◽  
Long Range ◽  
Time Scales ◽  
Multiple Time Scales ◽  
Multiple Time
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