AMBER Archive (2004)Subject: Re: AMBER: conversion of Amber 7 .pdb file to .bgf file
From: David A. Case (case_at_scripps.edu)
Date: Thu Mar 04 2004 - 16:59:21 CST
On Thu, Mar 04, 2004, Peter Oelschlaeger wrote:
> It seems as if Amber 7 names the
> hydrogens in another way than pdb convention.
ambpdb should give hydrogen names that match those in RCSB (the pdb). If
you find different results, you should report that as a bug. Please provide
a specific example.
...thanks...dave case
--
==================================================================
David A. Case | e-mail: case_at_scripps.edu
Dept. of Molecular Biology, TPC15 | fax: +1-858-784-8896
The Scripps Research Institute | phone: +1-858-784-9768
10550 N. Torrey Pines Rd. | home page:
La Jolla CA 92037 USA | http://www.scripps.edu/case
==================================================================
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu
|