Dear Colleagues, Did not anybody try to implement a possibility to use a changeable 'index.ndx' when analyzing a trajectory (g_rdf, g_velacc, etc)? I mean that the atoms numbers in 'index.ndx' could change, being different for different frames.
This trick can be used for evaluating properties of molecules located in the definite area at the current moment. Now we can control the particles but how can we check if these particles are still located in the same area where they were before they started to move? Of course, one is able to do it by visualizing trajectory and then edit the particles number by hand but it is quite unlucky solution, as for me. Probably I'll try to make something like it if time permits. If somebody has got any considerations on this topic, please let me know. -- Vitaly V. Chaban School of Chemistry National University of Kharkiv Svobody sq.,4, Kharkiv 61077, Ukraine email: [EMAIL PROTECTED] skype: vvchaban _______________________________________________ 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
