[gmx-users] Calculate RDF within a certain distance from atom

Dilip H N cy16f01.dilip at nitk.edu.in
Tue Feb 20 17:53:45 CET 2018

How to get RDF within a certain distance..??

Say for eg., i have glycine amino-acid and i want the RDF of Oxygen water
atoms within 0.7nm of C-alpha (Calpha-Ow).

how can i get it from in-house gmx rdf command...??

Any suggestions are appreciated...

Thank you.

With Best Regards,

Ph.D. Student

<https://mailtrack.io/> Sent with Mailtrack

More information about the gromacs.org_gmx-users mailing list