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MD simulation trajectory for POPC/20% Chol bilayer (CHARMM36, Gromacs 4.5)

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https://zenodo.org/records/14067
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资源简介:
Equilibrated POPC/20%CHL lipid bilayer ran with Gromacs 4.5 with CHARMM36 lipid forcefield. The simulation is composed of 100 POPC/24 Cholesterol at full hydratation and ran for 200ns at 303K, data saved every 20ps. All input parameters can be find on the github repository: https://github.com/NMRLipids/nmrlipids.blogspot.fi This data is used in the project "Matching lipid force fields with NMR data". More information at : http://nmrlipids.blogspot.fi/
创建时间:
2020-01-24
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