Hi, I think that my minimization are not running long enough. I've been following the parameters in tutorials but it seems like they all die at 34 steps
I've been using these tutorials https://extras.csc.fi/chem/courses/gmx2007/tutorial1/tutorial1.pdf http://md.chem.rug.nl/education/mdcourse/MDpract.html Its been the same case for me regardless to whether I use Windows or Linux platforms. Are there settings I can use to make the simulation minimize longer or is this case where I need to have double precision version? -- Jack http://www.facebook.com/home.php#/profile.php?id=832713248 http://hydrogenathome.org _______________________________________________ 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 gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/mailing_lists/users.php
