Dear users, For simulating a protein at high temperature (more than 300K, less than 400K) using OPLSAA forcefield, what are the parameters other than Temperature that need to be taken care of? Does the energy minimization step also needs to be done at high temperature? (here my aim is not to simulate an unfolding event) I have a reference - Biophysical Journal Volume 94 June 2008 4444–4453
Any other references or suggestions will be helpful. Thanking you With Regards M. Kavyashree
-- 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