On Wed, 15 Aug 2007, burkhard rammner wrote: > >Dear David, > >although I am a former biochemist (and do now 3D productions for >scientific purposes) I never came in contact with MD before. >Besides my "normal" molecule visualisation stuff I now try to do protein >folding with gromacs. > >What I do is: >create a protein myself, fold it to a some degree manually. > >Then I would need to do short MD to let the protein zip together, to get >a "scientiffically correct" folded protein. > >So, all I want to do is a hopefully simple energy minimisation and MD. > >Now my question to you is: >Does it make sense to try to learn Gromacs myself, or would I have to >definitely take some semesters at the university? >Are there resources, other than the manual and some internet tutorials >which could aid me? > >many thanks in advance >and best greetings > >Burkhard > > > >
-- David. ________________________________________________________________________ David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group, Dept. of Cell and Molecular Biology, Uppsala University. Husargatan 3, Box 596, 75124 Uppsala, Sweden phone: 46 18 471 4205 fax: 46 18 511 755 [EMAIL PROTECTED] [EMAIL PROTECTED] http://xray.bmc.uu.se/~spoel ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ _______________________________________________ gmx-users mailing list [email protected] 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
