I'm trying to repeat some X-ray diffraction analysis on lipid bilayers according to the article:
http://dx.doi.org/10.1529/biophysj.104.046821 (it's free) I have several corrected OPLS all-atom bilayer models and I need to validate my model according to experimental x-ray diffraction data. But I can't understand, how '-sq' property of g_rdf can helps me to compute structure factor.. May be anybody have some experience in this theme? -- gmx-users mailing list [email protected] http://lists.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
