Published January 19, 2015 | Version v1

MD simulation trajectory for POPC/50% Chol bilayer (CHARMM36, Gromacs 4.5)

Authors/Creators

  • 1. Université Paris Diderot - Paris 7

Description

Equilibrated POPC/50%CHL lipid bilayer ran with Gromacs 4.5 with CHARMM36 lipid forcefield.
The simulation is composed of 80 POPC/80 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/

Files

Files (1.1 GB)

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md5:05250aba0c8e861c346e78a8d2fd8a76
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