AMBER Archive (2004)

Subject: Re: AMBER: use leap to build top & crd files for a pdb file with crytalline water molecules

From: Bill Ross (ross_at_cgl.ucsf.edu)
Date: Tue Dec 21 2004 - 16:57:13 CST

> HETATM 1080 O HOH 78 43.755 23.843 8.038 0.38 17.96 O

You may need to make these ATOM records with a TER after each.

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