AMBER Archive (2002)

Subject: nmr and positional restraint in input

From: Peter Varnai (Peter.Varnai_at_ibpc.fr)
Date: Wed Oct 09 2002 - 12:44:03 CDT

Dear Amber users,

There was a thread a while ago which implied that it is
possible to give both restraint definitions (nmropt=1 and ntr=1)
in the input file. What is the correct syntax for that?

Thanks,
Peter Varnai