1,2-dipalmitoyl-sn-glycero-3-phosphocholine

OPLS Gromacs by XYZ

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Lipid 1,2-dipalmitoyl-sn-glycero-3-phosphocholine (DPPC)
Pubchem CID:6139
Forcefield OPLS
Code Gromacs
Authors Jakob P. Ulmschneider and Martin B. Ulmschneider
Licence fair use
Curator Martin Ulmschneider
Abstract

OPLS-UA lipids consistent with the OPLS-AA force field.


Please cite: J.P. Ulmschneider & M.B. Ulmschneider, United Atom Lipid Parameters for Combination with the Optimized Potentials for Liquid Simulations All-Atom Force Field, JCTC 2009, 5(7), 1803–1813

References

Jakob P. Ulmschneider and Martin B. Ulmschneider, United Atom Lipid Parameters for Combination with the Optimized Potentials for Liquid Simulations All-Atom Force Field, J Chem Theory Computation 5 (2009), 1803–1813, doi: 10.1021/ct900086b, [no pubmed id]
Primary Experimental

Versions

Version 1
Topology
128-dppc.top 2e3f4e25de4e4c5a39559d32a69ce7413ed4e029
Parameters
opls-ua-lipid-atomtypes.itp 6478a31753df68961d77a9d977254ed9783e5e2e
dppc_opls.itp 1162ec24c64852c809b966e0a718f00f4ec6d365
PDB structure
Bilayer structure
128-dppc.pdb 0685ef846d2b522d3efabdc4ce4d23d9f6c1a1e0