AMBER Archive (2003)

Subject: Re: AMBER: Atom type in prepin file

From: Rhonda Torres (torres_at_scripps.edu)
Date: Wed Aug 13 2003 - 17:38:26 CDT


Hi Yong,

Antechamber only uses the chemical symbol (C, O, H, etc.) that
corresponds to the atom number of your purine-like compound.
You will likely have to appropritately alter the Antechamber generated
file prior to import into leap (prepin).

Rhonda
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu