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[XMakemol-announce] 5.13 released.
From: |
Matt Hodges |
Subject: |
[XMakemol-announce] 5.13 released. |
Date: |
Sun, 04 Jul 2004 22:01:18 +0100 |
User-agent: |
Gnus/5.1006 (Gnus v5.10.6) Emacs/21.3.50 (gnu/linux) |
A new version of XMakemol has been released:
http://savannah.nongnu.org/download/xmakemol/xmakemol-5.13.tar.gz
* New in XMakemol 5.13
** Customizable bounding box.
Bounding box parameters can now be specified in input files using the
BBOX_XYZ keyword to give the minimum and maximum bounding box
coordinates.
** Allow system to be split into molecules.
The start of a new molecule is signified by the keyword MOLECULE on
any atom's input line. Bond and H-bond factors are now split into
independent intermolecular and intramolecular values.
--
Dr. Matt Hodges
School of Chemistry
University of Birmingham
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