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Optimization of parallel implementation of UNRES package for coarse‐grained simulations to treat large proteins.

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Title: Optimization of parallel implementation of UNRES package for coarse‐grained simulations to treat large proteins.
Authors: Sieradzan, Adam K.1,2, Sans‐Duñó, Jordi3, Lubecka, Emilia A.4, Czaplewski, Cezary1,2, Lipska, Agnieszka G.1,2, Leszczyński, Henryk5, Ocetkiewicz, Krzysztof M.2, Proficz, Jerzy2, Czarnul, Paweł4, Krawczyk, Henryk2,4, Liwo, Adam1,2, adam@chem.univ.gda.pl
Source: Journal of Computational Chemistry; 2/5/2023, Vol. 44 Issue 4, p602-625, 24p
Database: Applied Science & Technology Source
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Header DbId: aci
DbLabel: Applied Science & Technology Source
An: 161180334
AccessLevel: 2
PubType: Academic Journal
PubTypeId: academicJournal
PreciseRelevancyScore: 0
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PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=aci&AN=161180334
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      – Type: doi
        Value: 10.1002/jcc.27026
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      – Code: eng
        Text: English
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        PageCount: 24
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      – TitleFull: Optimization of parallel implementation of UNRES package for coarse‐grained simulations to treat large proteins.
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            NameFull: Sieradzan, Adam K.
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            NameFull: Sans‐Duñó, Jordi
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          Dates:
            – D: 05
              M: 02
              Text: 2/5/2023
              Type: published
              Y: 2023
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              Value: 44
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