Dear all,
Has anyone used -check14 for grompp? When I tried it just now, I got segmentation fault. grompp works fine without the option -check14 (or with the option -nocheck14). The error message is as follows: grompp -f md01.mdp -c ala5 -p ala5 -check14 -o full Back Off! I just backed up mdout.mdp to ./#mdout.mdp.1# checking input for internal consistency... calling /lib/cpp... processing topology... Generated 137 of the 1128 non-bonded parameter combinations Excluding 3 bonded neighbours for Protein 1 turning H bonds into constraints... Excluding 2 bonded neighbours for SOL 783 turning H bonds into constraints... Segmentation fault Could anyone give me a hand? Thanks a lot in advance! Dongsheng _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users 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
