1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine
GROMOS-CKP
Gromacs by XYZ
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| Lipid |
1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine (DPPE)
Pubchem CID:65109 |
| Forcefield |
GROMOS-CKP |
| Code |
Gromacs |
| Authors |
Piggot TJ, Holdbrook DA, Khalid S |
| Licence |
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| Curator |
Tom Piggot |
| Abstract |
DPPE 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:
Electroporation of the E. coli and S. aureus Membranes: Molecular Dynamics Simulations of Complex Bacterial Membranes. Thomas J. Piggot, Daniel A. Holdbrook, and Syma Khalid. The Journal of Physical Chemistry B 2011 115 (45), 13381-13388.
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References
Piggot TJ, Holdbrook DA, Khalid S, Electroporation of the E. coli and S. aureus membranes: molecular dynamics simulations of complex bacterial membranes., J Phys Chem B
115
(2011),
13381-8, doi: 10.1021/jp207013v, pubmed:21970408 [pubmed] [hubmed]
Primary Experimental
Versions
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2
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| Bilayer structure |
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| Version |
1
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| Topology |
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| Parameters |
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| PDB structure |
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| Bilayer structure |
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