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NEW UNRES FORCE FIELD PACKAGE WITH FORTRAN 90

UNRES is a coarse-grained model of polypeptide chains. Until now, each version of UNRES (UNRESPACK v. 3.2 and earlier ones) has been written in Fortran 77. Due to the fact that Fortran 77 enables us to use only static arrays, the Fortran 77 version has significant memory problems, and consequently,...

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Bibliographic Details
Main Authors: EMILIA A. LUBECKA, ADAM LIWO
Format: Artigo
Language:Inglês
Published: Gdańsk University of Technology 2016-10-01
Series:TASK Quarterly
Subjects:
Online Access:https://journal.mostwiedzy.pl/TASKQuarterly/article/view/1830
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