The last 250ns of a 400ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:20, (350 POPC, 88 POPG), with Na+ counterions and 100mM CaCl2. The starting structure and lipid 17 parameters from here: https://zenodo.org/record/2585523#.Xbf0FC17FBx The starting structure was generated by removing appropriate number of POPG lipids to get 80:20 ratio. Dihedral types are corrected to type 9 as discussed here: https://github.com/NMRLipids/NMRlipidsIVPEandPG/issues/12
<p>MD simulation trajectory and related files for fully hydrated POPC bilayer with 1M CaCl2. The LIP...
Equilibrated POPC lipid bilayer ran with Gromacs 5.1.2 with CHARMM36 lipid forcefield. The simulatio...
MD simulation trajectory and related files for fully hydrated POPC bilayer with 0.15M NaCl. The LIPI...
The last 198ns of a 718ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
The last 200ns of 720ns of MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50...
The last 350ns from a 400ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:2...
The last 200ns from a 1200ns MD simulation trajectory with Amber lipid 17. POPC-POPG 80:20 (POPC 350...
The last 200ns of a 320ns MD simulation trajectory with Amber lipid 17 force field. POPC:POPG 50:50 ...
The last 150ns from a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:2...
The last 150ns from a 200ns MD simulation trajectory with Amber lipid 17. POPC-POPG 80:20 (POPC 350,...
The last 150ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:20,...
The last 150ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
The first 53ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
The last 150ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
MD simulation trajectory and related files for fully hydrated POPC bilayer with 1M CaCl2. The LIPID1...
<p>MD simulation trajectory and related files for fully hydrated POPC bilayer with 1M CaCl2. The LIP...
Equilibrated POPC lipid bilayer ran with Gromacs 5.1.2 with CHARMM36 lipid forcefield. The simulatio...
MD simulation trajectory and related files for fully hydrated POPC bilayer with 0.15M NaCl. The LIPI...
The last 198ns of a 718ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
The last 200ns of 720ns of MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50...
The last 350ns from a 400ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:2...
The last 200ns from a 1200ns MD simulation trajectory with Amber lipid 17. POPC-POPG 80:20 (POPC 350...
The last 200ns of a 320ns MD simulation trajectory with Amber lipid 17 force field. POPC:POPG 50:50 ...
The last 150ns from a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:2...
The last 150ns from a 200ns MD simulation trajectory with Amber lipid 17. POPC-POPG 80:20 (POPC 350,...
The last 150ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 80:20,...
The last 150ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
The first 53ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
The last 150ns of a 200ns MD simulation trajectory with Amber lipid 17 force field. POPC-POPG 50:50 ...
MD simulation trajectory and related files for fully hydrated POPC bilayer with 1M CaCl2. The LIPID1...
<p>MD simulation trajectory and related files for fully hydrated POPC bilayer with 1M CaCl2. The LIP...
Equilibrated POPC lipid bilayer ran with Gromacs 5.1.2 with CHARMM36 lipid forcefield. The simulatio...
MD simulation trajectory and related files for fully hydrated POPC bilayer with 0.15M NaCl. The LIPI...