> follow the last problem ,i checked my gro,itp and modifid,but this time > ,"invalid command line argument",what's that mean? is still my mdp'wrong? > but this mdp that i test well in other gro ,and itp in ffgrom96,and this time > ,my forcefield is ffoplsaa,is there any different in the mdp?
It means exactly what it says, there is a command line argument that is incorrect. What is the exact command that you executed to run the script? There is likely a space in the command line text, incorrect letter or something like that. _______________________________________________ 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