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Scalable molecular dynamics with NAMD.
Phillips JC, Braun R, Wang W, Gumbart J, Tajkhorshid E, Villa E, Chipot C, Skeel RD, Kalé L, Schulten K. Phillips JC, et al. Among authors: kale l. J Comput Chem. 2005 Dec;26(16):1781-802. doi: 10.1002/jcc.20289. J Comput Chem. 2005. PMID: 16222654 Free PMC article.
Scalable molecular dynamics on CPU and GPU architectures with NAMD.
Phillips JC, Hardy DJ, Maia JDC, Stone JE, Ribeiro JV, Bernardi RC, Buch R, Fiorin G, Hénin J, Jiang W, McGreevy R, Melo MCR, Radak BK, Skeel RD, Singharoy A, Wang Y, Roux B, Aksimentiev A, Luthey-Schulten Z, Kalé LV, Schulten K, Chipot C, Tajkhorshid E. Phillips JC, et al. Among authors: kale lv. J Chem Phys. 2020 Jul 28;153(4):044130. doi: 10.1063/5.0014475. J Chem Phys. 2020. PMID: 32752662 Free PMC article.
Scalable Molecular Dynamics with NAMD on the Summit System.
Acun B, Hardy DJ, Kale LV, Li K, Phillips JC, Stone JE. Acun B, et al. Among authors: kale lv. IBM J Res Dev. 2018 Nov-Dec;62(6):1-9. doi: 10.1147/jrd.2018.2888986. Epub 2018 Dec 21. IBM J Res Dev. 2018. PMID: 32154805 Free PMC article.
23 results