AMBER Archive (2001)

Subject: leap not reaing torsion from frcmod file

From: Eoin Galligan (paxeg_at_nottingham.ac.uk)
Date: Thu Jun 07 2001 - 08:45:22 CDT

Dear all,

I've come across the following problem - leap only partly reads my frcmod file. Its seems happy with the majority of it, but cant seem to find a single certain torsion which is in the file! The atom types involved in the torsion are new and so are defined in the frcmod file. Thanks in advance for any help.

Regards, E Galligan