cholesterol
Slipids/AMBER
Gromacs by XYZ
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| Lipid |
cholesterol (chol)
Pubchem CID:5997 |
| Forcefield |
Slipids/AMBER |
| Code |
Gromacs |
| Authors |
Jämbeck JP, Lyubartsev AP |
| Licence |
  |
| Curator |
Joakim Jämbeck |
| Abstract |
See http://people.su.se/~jjm/Stockholm_Lipids/Home.html for for more details and structure files to download |
References
Jämbeck JP, Lyubartsev AP, Derivation and systematic validation of a refined all-atom force field for phosphatidylcholine lipids., J Phys Chem B
116
(2012),
3164-79, doi: 10.1021/jp212503e, pubmed:22352995 [pubmed] [hubmed]
Primary Experimental
Jämbeck, J. P. M. and Lyubartsev, A. P., An Extension and Further Validation of an All-Atomistic Force Field for Biological Membranes, J. Chem. Theory Comput.
8
(2012),
2938–2948, doi: 10.1021/ct300342n, [no pubmed id]
Primary Experimental
Jämbeck, J. P. M. and Lyubartsev, A. P., Another Piece of the Membrane Puzzle: Extending Slipids Further, J. Chem. Theory Comput.
(2012),
doi: 10.1021/ct300777p, [no pubmed id]
Primary Experimental
Versions
| Version |
2
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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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| Version |
1
|
| Topology |
|
| Parameters |
|
| PDB structure |
| chol.gro |
d128316d3444c5a25aed8d77484317d5aa6b74f5 |
| chol.pdb |
c521e1a4e5ee4c444abb7b48ab5011bd334b4331 |
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| Bilayer structure |
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