POPC @ 310K, Slipids force field.

Input parameter file and part of the resulting trajectory for a POPC bilayer simulation using the Slipids force field [1,2]. Initial structure, force field parameters and simulation parameters were taken from the Slipids web page (people.su.se/~jjm/Stockholm_Lipids/Downloads.html). The structure simulated at 303K was used (people.su.se/~jjm/Stockholm_Lipids/Downloads_files/POPC_303K.gro) This data is used in the project "Matching lipid force fields with NMR data", see: nmrlipids.blogspot.fi. –––––––––––––––––––––––––––––––––––––––––––––––––––––––––––––––––– Files: md.tpr – run input file for Gromacs versions 4.6 and above md.xtc – The last 150 ns of a 200 ns long simulation.

Data saved every 100 ps. –––––––––––––––––––––––––––––––––––––––––––––––––––––––––––––––––– [1] Joakim P. M. Jämbeck, Alexander P. Lyubartsev. Derivation and Systematic Validation of a Refined All-Atom Force Field for Phosphatidylcholine Lipids , J. Phys. Chem.