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Data including GROMACS input files for atomistic molecular dynamics simulations of mixed, asymmetric bilayers including molecular topologies, equilibrated structures, and force field for lipids compatible with OPLS-AA parameters

In this Data in Brief article we provide a data package of GROMACS input files for atomistic molecular dynamics simulations of multicomponent, asymmetric lipid bilayers using the OPLS-AA force field. These data include 14 model bilayers composed of 8 different lipid molecules. The lipids present in...

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Foilsithe in:Data Brief
Main Authors: Róg, Tomasz, Orłowski, Adam, Llorente, Alicia, Skotland, Tore, Sylvänne, Tuulia, Kauhanen, Dimple, Ekroos, Kim, Sandvig, Kirsten, Vattulainen, Ilpo
Formáid: Artigo
Teanga:Inglês
Foilsithe: Elsevier 2016
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC5063793/
https://ncbi.nlm.nih.gov/pubmed/27761499
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.dib.2016.03.067
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