The tabulated potentials I am using is non-bonded interactions. The question is the application of these potentials will only modify the force field, e.g. amber03, or will take place of the force field?
On Mon, Nov 14, 2011 at 6:40 PM, Mark Abraham <mark.abra...@anu.edu.au>wrote: > On 15/11/2011 9:33 AM, Liu, Liang wrote: > > I have a serial of tabulated potentials with the name of *.xvg, which are > the function of atom distance. > I am wondering how to use them in gromacs simulation? Will that replace > the force field, e.g. amber03? Thanks. > > > There are sections in the manual that describe the use of tabulated > potentials for either bonded or non-bonded interactions. Such tables modify > the force field in the expected manner. > > Mark > > -- > gmx-users mailing list gmx-users@gromacs.org > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/Search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to gmx-users-requ...@gromacs.org. > Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > -- Best, Liang Liu
-- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
