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Andrew J. Ballard, Ph.D. - Publications

Affiliations: 
2012 Chemical Physics University of Maryland, College Park, College Park, MD 
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5 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2015 Somani S, Okamoto Y, Ballard AJ, Wales DJ. Equilibrium molecular thermodynamics from Kirkwood sampling. The Journal of Physical Chemistry. B. 119: 6155-69. PMID 25915525 DOI: 10.1021/Acs.Jpcb.5B01800  0.436
2015 Ballard AJ, Martiniani S, Stevenson JD, Somani S, Wales DJ. Exploiting the potential energy landscape to sample free energy Wiley Interdisciplinary Reviews: Computational Molecular Science. 5: 273-289. DOI: 10.1002/Wcms.1217  0.356
2014 Ballard AJ, Wales DJ. Superposition-Enhanced Estimation of Optimal Temperature Spacings for Parallel Tempering Simulations. Journal of Chemical Theory and Computation. 10: 5599-5605. PMID 25512744 DOI: 10.1021/Ct500797A  0.362
2012 Ballard AJ, Jarzynski C. Replica exchange with nonequilibrium switches: enhancing equilibrium sampling by increasing replica overlap. The Journal of Chemical Physics. 136: 194101. PMID 22612074 DOI: 10.1063/1.4712028  0.5
2009 Ballard AJ, Jarzynski C. Replica exchange with nonequilibrium switches. Proceedings of the National Academy of Sciences of the United States of America. 106: 12224-9. PMID 19592512 DOI: 10.1073/Pnas.0900406106  0.498
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