Adam Pratt
Affiliations: | 2013- | Chemistry | University of Pittsburgh, Pittsburgh, PA, United States |
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| Bogetti AT, Mostofian B, Dickson A, et al. (2019) A Suite of Tutorials for the WESTPA Rare-Events Sampling Software [Article v1.0]. Living Journal of Computational Molecular Science. 1 |
| Pratt A, Zuckerman DM, Chong LT. (2018) WESTPA 2.0 Advances in Sampling, Storage, and Analysis of Weighted Ensemble Simulations Biophysical Journal. 114: 677a |
| Zwier MC, Pratt A, Adelman JL, et al. (2016) Efficient Atomistic Simulation of Pathways and Calculation of Rate Constants for a Protein-Peptide Binding Process: Application to the MDM2 Protein and an Intrinsically Disordered p53 Peptide. The Journal of Physical Chemistry Letters |
| Zwier MC, Adelman JL, Kaus JW, et al. (2015) WESTPA: An interoperable, highly scalable software package for weighted ensemble simulation and analysis. Journal of Chemical Theory and Computation. 11: 800-809 |
| Suárez E, Pratt AJ, Chong LT, et al. (2015) Estimating first-passage time distributions from weighted ensemble simulations and non-Markovian analyses. Protein Science : a Publication of the Protein Society |
| Zwier MC, Adelman JL, Kaus JW, et al. (2015) WESTPA: An interoperable, highly scalable software package for weighted ensemble simulation and analysis Journal of Chemical Theory and Computation. 11: 800-809 |