From: Basanta Acharya (
Date: Tue Sep 15 2020 - 06:59:12 CDT

Namaste everyone,
I am going to pass arsorite - water solution through a carbon nanotube to
see the adsorption nature of CNT. I have downloaded sdf file of arsorite
and converted it to .mol2 format using openbabel then i got problem in
generating psf file as i donot have topology files. how can i obtain its
topology files ? How can i generate psf file? and how can i get parameters
file for this work?

Looking for good solution. Thank you!

Basanta Acharya