[AMBER] Query regarding force fields

Contemporary messages sorted: [ by date ] [ by thread ] [ by subject ] [ by author ] [ by messages with attachments ]

From: SHAUNAK BADANI <shaunak.badani.research.iiit.ac.in>
Date: Fri, 15 May 2020 18:10:15 +0000

Hi all,

I want to generate force field parameters for ATP. My model system contains ATP bound to protein, solvated in water. I am following the Antechamber tutorial (which uses GAFF to generate Drug parameters) available on the Amber website to generate ATP parameters. I just want to make sure I am right in doing so.

Thanks and regards,
Shaunak Badani
IIIT Hyderabad

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Fri May 15 2020 - 11:30:01 PDT