===================================== 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: Fair Use (http://www.copyrightservice.co.uk/copyright/p09_fair_use) 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-dilauroyl-sn-glycero-3-phosphocholine (DLPC) Forcefield: GROMOS43A1-S3 Code: Gromacs Version: 1 (created: 31-05-2012, last update: 01-06-2012) Curator: Oliver Beckstein Lipidbook URL: http://lipidbook.bioch.ox.ac.uk/version/show/id/89.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. dlpc.gro : c6412feb798a9494fe17e3f27b39d5d7f98bfd3a dlpc.itp : 80973db54f26e463825fdd0d2aa60efc995f349d dlpc.pdb : 5df241d17c5bfda5f65891bde76c069a5e5128c4 dlpc_structure.gro : dd2463261644a1e4d02015fb3d479f81eb985505 dlpc_structure.pdb : a6b881cf1b8fe5a83bd2e7d501972b1d2ec0de70 ffG43A1-S3.02.itp : e9dce266afc5dd7713aeaa44c4c77a4e7311405d links.txt : d84581cced2d2ad7eae3a3486b973388289167cd SHA1 of all files : abfa6159dd87d2942fc0290735ab21fd5a9d44aa Primary reference(s) =================== Please always credit the original authors of the parameters by citing these papers: Title: An improved united atom force field for simulation of mixed lipid bilayers. Authors: Chiu SW, Pandit SA, Scott HL, Jakobsson E Journal: J Phys Chem B Year: 2009 Mar 5 Volume: 113 Page: 2748-63 pubmed id: 19708111 doi: 10.1021/jp807056c Additional notes: -