I used VMD to process a gro file and wrote it to pdb, because VMD can't write gro files. Because the # of residues exceeds 9999, it numbered the remaining residues in the PDB in 4 bit hex. Editconf will not convert the hex numbered residue ids back to decimal (it just truncates anything past the final 0-9 digit in the field). Does this mean if I feed the pdb as-is into grompp it will also have problems reading the residue numbers?
Gromacs 4.5.3 -- ================================================================== Peter C. Lai | University of Alabama-Birmingham Programmer/Analyst | KAUL 752A Genetics, Div. of Research | 705 South 20th Street [email protected] | Birmingham AL 35294-4461 (205) 690-0808 | ================================================================== -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/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/Support/Mailing_Lists
