Hello friends again i have faced the problem this time i have taken the Hydrolase ( TRYPSIN BEFORE A HIGH DOSE X-RAY "BURN") .i have taken the pdb file. i have edited the pdb file in the text editor i have removed all the hetero atoms and and put them in the dundee prodrg server and collected the archieves then i vave puted the pdb file containing only amino acid residue informations in to the pdb2gmax and got gromos and top file later i have edited the gro file using the archieve from the server which contain the gromos format of the hetero atom then i have edited the top file using the itp file of collected archieve archieve and put them in editconf and genbox. but when i run the grompp it shows the error like the atom CR61 was not found can anyone help me over this
thanking you santosh naik _______________________________________________ gmx-users mailing list [email protected] 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
