Optimization of parallel implementation of UNRES package for coarse-grained simulations to treat large proteins - researchr publication authors

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Adam K. Sieradzan, Jordi Sans-Duñó, Emilia A. Lubecka, Cezary Czaplewski, Agnieszka G. Lipska, Henryk Leszczynski, Krzysztof M. Ocetkiewicz, Jerzy Proficz, Pawel Czarnul, Henryk Krawczyk, Adam Liwo. Optimization of parallel implementation of UNRES package for coarse-grained simulations to treat large proteins. Journal of Computational Chemistry, 44(4):602-625, February 2023. [doi]

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