> tcoupl = Berendsen > tc-grps = Protein SOL DRG Cl > tau_t = 0.1 0.1 0.1 0.1 > ref_t = 300 300 300 0.1
This could also be a problem. Never couple solvent and ions separately. Also note that you have your temperature of Cl set for 0.1 K! > Pcoupl = Berendsen > tau_p = 1.0 > compressibility = 4.5e-5 > ref_p = 1.0 > gen_vel = yes > gen_temp = 300 > gen_seed = 173529 > constraints = all-bonds > -------------------------- > > Many thanks in advance! > > > Kind Regards, > Blaise > -Justin ====================== Justin A. Lemkul Graduate Research Assistant Department of Biochemistry Virginia Tech Blacksburg, VA [EMAIL PROTECTED] | (540) 231-9080 http://bevanlab.biochem.vt.edu/Pages/Personal/justin/ ====================== _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php
