He told me you can use up to 0.5 in an off-list email and in fact, does so in the KALP-15 in DPPC example...
On 2011-04-10 02:54:15AM -0500, mohsen ramezanpour wrote: > Dear Dr.Justin > > As you have noticed in your tutorials,It is better to use Nose-Hoover for > tempreture in the NPT.mdp file. > You have used tau-t = 0.1 in most of your md.mdp files for generating npt > ensemble. > > When I use a npt file with these settings,there is a Note as following: > sorry,i can't remember the exact messge but :it says it is better to use a > tau_t 20 times of another quantity, > in my work the quantity=0.01 > > When I made tau_t=0.2 there was not any Note! > > Can I ignore this Note?Is it safe continuing with the same tau_t=0.1 as you > used? > > -- > gmx-users mailing list [email protected] > 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 [email protected]. > Can't post? Read http://www.gromacs.org/Support/Mailing_Lists -- =============================================================== Peter C. Lai | University of Alabama-Birmingham Programmer/Analyst | BEC 257 Genetics, Div. of Research | 1150 10th Avenue South [email protected] | Birmingham AL 35294-4461 (205) 690-0808 | =============================================================== -- gmx-users mailing list [email protected] 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 [email protected]. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
