On 4/10/14, 2:23 AM, madhura khare wrote:
Hello all, I got the pre equilibrated POPE/POPG 3:1 bilayer from http://www.softsimu.net/downloads.shtml While introducing the peptide to it found error with AtomTypes. I am using charmm36-mar2014.ff. How to solve this?
You need to provide actual diagnostic information - exact commands used, the exact error message (everything copied and pasted from the terminal), otherwise the only response to "there was an error" is "you made a mistake." To get something more useful, and efficiently, be precise in what's going on.
-Justin -- ================================================== Justin A. Lemkul, Ph.D. Ruth L. Kirschstein NRSA Postdoctoral Fellow Department of Pharmaceutical Sciences School of Pharmacy Health Sciences Facility II, Room 601 University of Maryland, Baltimore 20 Penn St. Baltimore, MD 21201 jalem...@outerbanks.umaryland.edu | (410) 706-7441 http://mackerell.umaryland.edu/~jalemkul ================================================== -- 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.
