hi, i want to ask if there is a possibility to make distance restraints or contraints over two molecules? till now i have two .itp files (one for each molecule) and i include them with 'inculde "...itp" . after that i have [ system ] and [ molecules ] (with my two molecules) and then [ distance_restraints ] respectively [ contraints ].
but in both cases i get after grompp: [ file "info.top", line 14 ]: Atom index (6) in distance_restraints out of bounds (1-5). so i think the problem is that i have two molecules. but is there probably another way to get this work?!? thanks for an answer. thomas schlesier _______________________________________________ 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
