hi please refer to my mail http://www.gromacs.org/pipermail/gmx-users/2008-March/033024.html I posted a question regarding taup_p to be used with anisotropic coupling. As qoted "A reasonable choice for relaxation time would be 100 fs. The compressibility and the relaxation time appear only as a ratio in the dynamics, so a larger compressibility is equivalent to a smaller relaxation time." I want to ask if we can give the value of tau_p 0.0 for diagonal elements while specifying for anisotropic coupling. Both tau_p 0.0 as well as 1.0 continue to run.
Any comments would be appreciated Cheers Pragya Chohan _________________________________________________________________ Fashion Channel : Want to know what’s the latest in the fashion world ? You have it all here on MSN Fashion. http://lifestyle.in.msn.com/_______________________________________________ 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
