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Efficient nonbonded interactions for molecular dynamics on a graphics processing unit.

P. Eastman, and V. Pande. J. Comput. Chem., 31 (6): 1268-1272 (2010)

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Balakumar Vijayakrishnan

Amit Pande

Samay Pande

Vijay Divi

Vijay Singh

Other publications of authors with the same name

Folding and misfolding of the collagen triple helix: Markov analysis of molecular dynamics simulationsS. Park, T. Klein, and V. Pande. BIOPHYSICAL JOURNAL, 93 (12): 4108-4115 (December 2007)Meeting halfway on the bridge between protein folding theory and experimentV. Pande. Proceedings of National Academy of Sciences, 100 (7): 3555--3556 (April 2003)Folding@Home and Genome@Home: Using distributed computing to tackle previously intractable problems in computational biologyS. Larson, C. Snow, M. Shirts, and V. Pande. (2002)How well can simulation predict protein folding kinetics and thermodynamics?C. Snow, E. Sorin, Y. Rhee, and V. Pande. Annual Review Biophys. BioMol. Struct., (2005)Everything you wanted to know about Markov State Models but were afraid to askV. Pande, K. Beauchamp, and G. Bowman. Methods, 52 (1): 99--105 (2010)Using path sampling to build better Markovian state models: Predicting the folding rate and mechanism of a tryptophan zipper beta hairpinN. Singhal, C. Snow, and V. Pande. Journal of Chemical Physics, 121 (1): 415-425 (2004)Decision functions from supervised machine learning algorithms as collective variables for accelerating molecular simulations.M. Sultan, and V. Pande. CoRR, (2018)Graph Convolutional Policy Network for Goal-Directed Molecular Graph Generation.J. You, B. Liu, R. Ying, V. Pande, and J. Leskovec. CoRR, (2018)Note: Variational Encoding of Protein Dynamics Benefits from Maximizing Latent Autocorrelation.H. Wayment-Steele, and V. Pande. CoRR, (2018)Retrosynthetic reaction prediction using neural sequence-to-sequence models.B. Liu, B. Ramsundar, P. Kawthekar, J. Shi, J. Gomes, Q. Nguyen, S. Ho, J. Sloane, P. Wender, and V. Pande. CoRR, (2017)

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Disambiguation of "Pande, Vijay S."

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Efficient nonbonded interactions for molecular dynamics on a graphics processing unit.

Please choose a person to relate this publication to

Balakumar Vijayakrishnan

Amit Pande

Samay Pande

Vijay Divi

Vijay Singh

Other publications of authors with the same name

Disambiguation

BibSonomy

Disambiguation of "Pande, Vijay S."

copydeleteadd this publication to your clipboardcommunity posthistory of this postURLDOIBibTeXEndNoteAPAChicagoDIN 1505HarvardMSOffice XML Efficient nonbonded interactions for molecular dynamics on a graphics processing unit.

Please choose a person to relate this publication to

Balakumar Vijayakrishnan

Amit Pande

Samay Pande

Vijay Divi

Vijay Singh

Other publications of authors with the same name

Disambiguation

copy delete add this publication to your clipboard
community post
history of this post
URL
DOI
BibTeX
EndNote
APA
Chicago
DIN 1505
Harvard
MSOffice XML

Efficient nonbonded interactions for molecular dynamics on a graphics processing unit.