===================================== Force field parameters from Lipidbook ===================================== Parameter files in this zip file were downloaded from lipidbook.bioch.ox.ac.uk. Linked parameters need to be manually downloaded via the links in links.txt. Always cite the primary reference(s) for the parameters, which can be found at the end of this file. Please cite Lipidbook in your published work with the reference J. Domanski, P. Stansfeld, M.S.P. Sansom, and O. Beckstein. Lipidbook: A Public Repository for Force Field Parameters Used in Membrane Simulations. J. Membrane Biol. 236 (2010), 255--258. doi:10.1007/s00232-010-9296-8. URL:http://lipidbook.bioch.ox.ac.uk License: CC-Attribute-ShareAlike 3.0 (cc-by-sa-3.0 http://creativecommons.org/licenses/by-sa/3.0/) NOTE: The licence REQUIRES that you cite the primary reference when you use and/or modify these files. See the link under Licence for details. Overview ======== Lipid: 1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine (DPPE) Forcefield: GROMOS-CKP Code: Gromacs Version: 1 (created: 22-05-2012, last update: 22-05-2012) Curator: Tom Piggot Lipidbook URL: http://lipidbook.bioch.ox.ac.uk/version/show/id/83.html File manifest ============= Downloaded files are listed with SHA1 checksums. You can compute the checksums of the downloaded files (e.g. with the 'openssl sha1' or the 'sha1sum' commands) and compare them to the listed ones. If they agree you have verified the files; it also allows a simple check of which files changed between versions. DPPE_GROMOS-CKP.itp : 8302382ea9ee8ef90eabe8f308c6ad5c11ac611e md-DPPE_200ns.gro : 4a59df4f92f6487bf446ccf0ca977e8cf0098299 SHA1 of all files : b7187c60237e24552e7a91d225c4acd2481eb51f Primary reference(s) =================== Please always credit the original authors of the parameters by citing these papers: Title: Electroporation of the E. coli and S. aureus membranes: molecular dynamics simulations of complex bacterial membranes. Authors: Piggot TJ, Holdbrook DA, Khalid S Journal: J Phys Chem B Year: 2011 Nov 17 Volume: 115 Page: 13381-8 pubmed id: 21970408 doi: 10.1021/jp207013v Additional notes: -