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Debolt, Stephen E., Kollman, Peter A. (1993) AMBERCUBE MD, parallelization of Amber's molecular dynamics module for distributed-memory hypercube computers. Journal of Computational Chemistry, 14 (3). 312-329 doi:10.1002/jcc.540140307

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Reference TypeJournal (article/letter/editorial)
TitleAMBERCUBE MD, parallelization of Amber's molecular dynamics module for distributed-memory hypercube computers
JournalJournal of Computational Chemistry
AuthorsDebolt, Stephen E.Author
Kollman, Peter A.Author
Year1993 (March)Volume14
Issue3
PublisherWiley
DOIdoi:10.1002/jcc.540140307Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID3146058Long-form Identifiermindat:1:5:3146058:3
GUID0
Full ReferenceDebolt, Stephen E., Kollman, Peter A. (1993) AMBERCUBE MD, parallelization of Amber's molecular dynamics module for distributed-memory hypercube computers. Journal of Computational Chemistry, 14 (3). 312-329 doi:10.1002/jcc.540140307
Plain TextDebolt, Stephen E., Kollman, Peter A. (1993) AMBERCUBE MD, parallelization of Amber's molecular dynamics module for distributed-memory hypercube computers. Journal of Computational Chemistry, 14 (3). 312-329 doi:10.1002/jcc.540140307
In(1993, March) Journal of Computational Chemistry Vol. 14 (3) Wiley

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Jones, Douglas M., Goodfellow, Julia M. (1993) Parallelization strategies for molecular simulation using the Monte Carlo algorithm. Journal of Computational Chemistry, 14 (2). 127-137 doi:10.1002/jcc.540140202
DeBolt, Stephen E., Kollman, Peter A. (1995) Investigation of Structure, Dynamics, and Solvation in 1-Octanol and Its Water-Saturated Solution: Molecular Dynamics and Free-Energy Perturbation Studies. Journal Of The American Chemical Society, 117 (19) 5316-5340 doi:10.1021/ja00124a015
Jung, Jaewoon, Mori, Takaharu, Sugita, Yuji (2014) Midpoint cell method for hybrid (MPI+OpenMP) parallelization of molecular dynamics simulations. Journal of Computational Chemistry, 35 (14). 1064-1072 doi:10.1002/jcc.23591
Sun, Yaxiong, Kollman, Peter A. (1992) Conformational sampling and ensemble generation by molecular dynamics simulations: 18-Crown-6 as a test case. Journal of Computational Chemistry, 13 (1). 33-40 doi:10.1002/jcc.540130105
Lin, S.L., Mellor-Crummey, J., Pettitt, B.M., Phillips, G.N. (1992) Molecular dynamics on a distributed-memory multiprocessor. Journal of Computational Chemistry, 13 (8). 1022-1035 doi:10.1002/jcc.540130813
Covick, Lawrence A., Sando, Kenneth M. (1990) Four-Index transformation on distributed-memory parallel computers. Journal of Computational Chemistry, 11 (10). 1151-1159 doi:10.1002/jcc.540111006
Hardy, B.J., Sarko, A. (1993) Molecular dynamics simulation of cellobiose in water. Journal of Computational Chemistry, 14 (7). 848-857 doi:10.1002/jcc.540140710
Roe, Daniel R., Cheatham, Thomas E. (2018) Parallelization of CPPTRAJ enables large scale analysis of molecular dynamics trajectory data. Journal of Computational Chemistry, 39 (25). 2110-2117 doi:10.1002/jcc.25382
 
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