Nmrlipids
Published January 19, 2015 | Version v1
Dataset Open

MD simulation trajectory and related files for POPC bilayer (CHARMM36, Gromacs 4.5)

Authors/Creators

  • 1. Université Paris Diderot Paris-7

Description

Equilibrated POPC lipid bilayer ran with Gromacs 4.5 with CHARMM36 lipid forcefield.
The simulation is composed of 128 POPC 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 (904.7 MB)

Name Size
md5:aeaf928ee56d3a19e4cd314a3ff3a119
1.5 MB Download
md5:ee53ce26fac79774b924a40fbb46ba7a
2.5 kB Download
md5:50fb8eadb2f9ecd0138c5c73345becc7
1.1 MB Download
md5:049a63321a81a1e79d51f36480bf3a4d
902.1 MB Download