Matches in SemOpenAlex for { <https://semopenalex.org/work/W2955477675> ?p ?o ?g. }
- W2955477675 endingPage "2508" @default.
- W2955477675 startingPage "2502" @default.
- W2955477675 abstract "Electrostatic potential, energies, and forces affect virtually any process in molecular biology, however, computing these quantities is a difficult task due to irregularly shaped macromolecules and the presence of water. Here, we report a new edition of the popular software package DelPhi along with describing its functionalities. The new DelPhi is a C++ object-oriented package supporting various levels of multiprocessing and memory distribution. It is demonstrated that multiprocessing results in significant improvement of computational time. Furthermore, for computations requiring large grid size (large macromolecular assemblages), the approach of memory distribution is shown to reduce the requirement of RAM and thus permitting large-scale modeling to be done on Linux clusters with moderate architecture. The new release comes with new features, whose functionalities and applications are described as well. © 2019 The Authors. Journal of Computational Chemistry published by Wiley Periodicals, Inc." @default.
- W2955477675 created "2019-07-12" @default.
- W2955477675 creator A5013853709 @default.
- W2955477675 creator A5015469857 @default.
- W2955477675 creator A5043873102 @default.
- W2955477675 creator A5051734783 @default.
- W2955477675 creator A5053958450 @default.
- W2955477675 creator A5054921936 @default.
- W2955477675 creator A5062619555 @default.
- W2955477675 creator A5066047116 @default.
- W2955477675 creator A5075727451 @default.
- W2955477675 creator A5082796473 @default.
- W2955477675 creator A5087472507 @default.
- W2955477675 date "2019-06-25" @default.
- W2955477675 modified "2023-10-15" @default.
- W2955477675 title "DelPhi Suite: New Developments and Review of Functionalities" @default.
- W2955477675 cites W1487420490 @default.
- W2955477675 cites W1521376799 @default.
- W2955477675 cites W1757081426 @default.
- W2955477675 cites W1974599488 @default.
- W2955477675 cites W1976190421 @default.
- W2955477675 cites W1987981639 @default.
- W2955477675 cites W2000087320 @default.
- W2955477675 cites W2000247209 @default.
- W2955477675 cites W2002052142 @default.
- W2955477675 cites W2004145462 @default.
- W2955477675 cites W2007258535 @default.
- W2955477675 cites W2012551774 @default.
- W2955477675 cites W2021534482 @default.
- W2955477675 cites W2025878809 @default.
- W2955477675 cites W2032579758 @default.
- W2955477675 cites W2032853185 @default.
- W2955477675 cites W2058653824 @default.
- W2955477675 cites W2074899677 @default.
- W2955477675 cites W2076407822 @default.
- W2955477675 cites W2078138500 @default.
- W2955477675 cites W2078159738 @default.
- W2955477675 cites W2080088737 @default.
- W2955477675 cites W2080823722 @default.
- W2955477675 cites W2086978190 @default.
- W2955477675 cites W2091916224 @default.
- W2955477675 cites W2092110472 @default.
- W2955477675 cites W2099672241 @default.
- W2955477675 cites W2100017567 @default.
- W2955477675 cites W2104155471 @default.
- W2955477675 cites W2106115249 @default.
- W2955477675 cites W2110562802 @default.
- W2955477675 cites W2112702439 @default.
- W2955477675 cites W2114589706 @default.
- W2955477675 cites W2114634948 @default.
- W2955477675 cites W2120056164 @default.
- W2955477675 cites W2120715487 @default.
- W2955477675 cites W2129448953 @default.
- W2955477675 cites W2152486318 @default.
- W2955477675 cites W2156777159 @default.
- W2955477675 cites W2190363753 @default.
- W2955477675 cites W2192013059 @default.
- W2955477675 cites W2325228488 @default.
- W2955477675 cites W2329374371 @default.
- W2955477675 cites W2340330302 @default.
- W2955477675 cites W2345728461 @default.
- W2955477675 cites W2580833673 @default.
- W2955477675 cites W2586281103 @default.
- W2955477675 cites W2609229915 @default.
- W2955477675 cites W2623747081 @default.
- W2955477675 cites W2731784911 @default.
- W2955477675 cites W2742985178 @default.
- W2955477675 cites W2766808155 @default.
- W2955477675 cites W2794835122 @default.
- W2955477675 cites W2893189760 @default.
- W2955477675 cites W2955477675 @default.
- W2955477675 cites W769759530 @default.
- W2955477675 doi "https://doi.org/10.1002/jcc.26006" @default.
- W2955477675 hasPubMedCentralId "https://www.ncbi.nlm.nih.gov/pmc/articles/6771749" @default.
- W2955477675 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/31237360" @default.
- W2955477675 hasPublicationYear "2019" @default.
- W2955477675 type Work @default.
- W2955477675 sameAs 2955477675 @default.
- W2955477675 citedByCount "36" @default.
- W2955477675 countsByYear W29554776752019 @default.
- W2955477675 countsByYear W29554776752020 @default.
- W2955477675 countsByYear W29554776752021 @default.
- W2955477675 countsByYear W29554776752022 @default.
- W2955477675 countsByYear W29554776752023 @default.
- W2955477675 crossrefType "journal-article" @default.
- W2955477675 hasAuthorship W2955477675A5013853709 @default.
- W2955477675 hasAuthorship W2955477675A5015469857 @default.
- W2955477675 hasAuthorship W2955477675A5043873102 @default.
- W2955477675 hasAuthorship W2955477675A5051734783 @default.
- W2955477675 hasAuthorship W2955477675A5053958450 @default.
- W2955477675 hasAuthorship W2955477675A5054921936 @default.
- W2955477675 hasAuthorship W2955477675A5062619555 @default.
- W2955477675 hasAuthorship W2955477675A5066047116 @default.
- W2955477675 hasAuthorship W2955477675A5075727451 @default.
- W2955477675 hasAuthorship W2955477675A5082796473 @default.
- W2955477675 hasAuthorship W2955477675A5087472507 @default.
- W2955477675 hasBestOaLocation W29554776751 @default.
- W2955477675 hasConcept C111919701 @default.