Hi all, I am currently doing simulations of triglycerides with the Berger parameters. Therefore, I built my topology files based on a phospholipid-file (in my case dppc.itp) from Peter Tielemans homepage (http://wcm.ucalgary.ca/tieleman/downloads). That means, I had to replace all phosphocholine entries of the dppc.itp with a third fatty acid, analogue to the fatty acids already in the file.
Editing the .itp file by hand is quite error-prone... Does anybody of you have a better idea how to do this? Or maybe knows a publication where they did the same and attached the files? Thank you in advance, Moritz -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
