Hello users This might come off as a stupid question but I am afraid to admit that I am confused.
What is the default state of "energygrps" in a GROMACS simulation ? I know that I can write energygrps = System or energygrps = A B etc. , but what happens if I do not specifiy any "energygrps" in a .mdp file. I checked the mdout.mdp generated during grompp+mdrun and found that energygrps = (blank). In that case what is happening ? I use version 4.6.7 and also checked the manual but could not satisfy myself. Kindly answer. Thanks & Regards Agnivo Gosai Grad Student, Iowa State University. -- 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.
