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Lipid | 1-palmitoyl,2-oleoyl-sn-glycero-3-phosphocholine (POPC) Pubchem CID:5497103 |
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Forcefield | GROMOS-CKP |
Code | Gromacs |
Authors | Piggot TJ, Piñeiro Á, Khalid S. |
Licence | ![]() ![]() |
Curator | Tom Piggot |
Abstract | POPC GROMOS-CKP lipid parameters. These lipid parameters can be used with the GROMOS 53A6 and GROMOS 54A7 protein force fields without any modifications to the parameters. If you use these parameters please read and cite: Molecular Dynamics Simulations of Phosphatidylcholine Membranes: A Comparative Force Field Study. Thomas J. Piggot, Ángel Piñeiro and Syma Khalid. Journal of Chemical Theory and Computation. DOI: 10.1021/ct3003157 |
Piggot TJ, Piñeiro Á, Khalid S., Molecular Dynamics Simulations of Phosphatidylcholine Membranes: A Comparative Force Field Study, Journal of Chemical theory and Computation
doi: 10.1021/ct3003157, [no pubmed id]
Primary Experimental
Version | 1 | ||
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PDB structure |
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Bilayer structure |
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