Long time step molecular dynamics using targeted Langevin stabilization

Proceedings of the ACM Symposium on Applied Computing

Volumn , Issue , 2003, Pages 178-182

  Ma, Qun ^a   Izaguirre, Jesus A ^a  

^a UNIVERSITY OF NOTRE DAME   (United States)

Author keywords

Long molecular dynamics simulations; Mollified Impulse; Multiple time stepping; Targeted Langevin stabilization; Verlet I r RESPA Impulse

Indexed keywords

COMPUTER SIMULATION; EQUATIONS OF MOTION; HAMILTONIANS; RESONANCE; VECTORS;

MULTIPLE TIME STEPPING;

MOLECULAR DYNAMICS;

EID: 0037661253     PISSN: None     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1145/952562.952570     Document Type: Conference Paper

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