[gmx-users] Regarding topology...

Dilip H N cy16f01.dilip at nitk.edu.in
Mon Jan 16 08:44:47 CET 2017

My questions are..
1] how to create a topology file for ammonia.??
2] how to create a force field for ammonia, what is the residue name for
ammonia in .pdb file.??
3] Why ammonia.itp is not  there in gromacs..??
4] Which force field to choose for ammonia..??

With Best Regards,

Ph.D Student,
Research Scholar,
Department of Chemistry,
National Institute of Technology-Karnataka,
Surathkal, Mangaluru - 575025.

 Sent with Mailtrack

More information about the gromacs.org_gmx-users mailing list