jayant_jacques at rediffmail.com
Fri Dec 14 22:44:39 CET 2007
I am attempting to simulate a protein with a modified amino acid using the Gromacs force field with hydrogens for NMR. I have built the RTP and TOP files using PRODRG.
I need to know what is the rtp file? relevant to the above force field such that I can append my rtp file. Is it the ffgmx2.rtp or ffgmx.rtp?
Jayasundar Jayant James
Department of Veterinary and Comparative Anatomy, Pharmacology and Physiology(VCAPP), Washington state university, Pullman 99164-6520, USA.
Phone office:335-5937, Cell:1-509-432-5790
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