I am trying to build an input deck for a dynamics simulation. Everything
seems to go well up to parm. When I try to run parm (AMBER5.0), I find
that I get the following error message :
Missing mass parameter: Atom number 759 type
You can get the v6 leap free from
ftp://odin.compchem.ucsf.edu/pub/a6.tar.gz
(includes leap & carnal only).
It may not solve your problem if you have omitted something,
but if so, any error msg it gives is likely to be more
informative, and it's easy to use:
% tleap
> x = loadpdb some.pdb
> saveamberparm x x.top x.crd
> quit
%
Bill Ross
Received on Sat Sep 23 2000 - 12:55:06 PDT
