[gmx-users] Making index file

bharat gupta bharat.85.monu at gmail.com
Wed Nov 5 03:27:23 CET 2014


I want to make an index file for a certain residue, say residue 14 and its
atom CA. I can eaily do that if its a single chain protein, but my protein
contains 10 chains and I don't know how to select residue 14 from each
chain. I tried splitting the protein into chains by using splitch option,
but I don't know how proceed after that.

Please help
*Best Regards*

More information about the gromacs.org_gmx-users mailing list