Bug#121296: marked as done (ITP: ghemical -- A GNOME molecular modelling environment)
Your message dated Tue, 04 Dec 2001 15:01:04 -0500
with message-id <E16BLkW-0001Jm-00@auric.debian.org>
and subject line Bug#121296: fixed in ghemical 0.81-1
has caused the attached Bug report to be marked as done.
This means that you claim that the problem has been dealt with.
If this is not the case it is now your responsibility to reopen the
Bug report if necessary, and/or fix the problem forthwith.
(NB: If you are a system administrator and have no idea what I am
talking about this indicates a serious mail system misconfiguration
somewhere. Please contact me immediately.)
Debian bug tracking system administrator
(administrator, Debian Bugs database)
--------------------------------------
Received: (at submit) by bugs.debian.org; 26 Nov 2001 20:51:37 +0000
>From mbanck@gmx.net Mon Nov 26 14:51:37 2001
Return-path: <mbanck@gmx.net>
Received: from mail.gmx.net [213.165.64.20]
by master.debian.org with smtp (Exim 3.12 1 (Debian))
id 168Sj3-0007AU-00; Mon, 26 Nov 2001 14:51:37 -0600
Received: (qmail 32400 invoked by uid 0); 26 Nov 2001 20:51:05 -0000
Received: from pc19f6c6b.dip.t-dialin.net (HELO Blackbird) (193.159.108.107)
by mail.gmx.net (mp011-rz3) with SMTP; 26 Nov 2001 20:51:05 -0000
Received: from mbanck by Blackbird with local (Exim 3.22 #1 (Debian))
id 168SBp-0007EC-00
for <submit@bugs.debian.org>; Mon, 26 Nov 2001 21:17:17 +0100
Date: Mon, 26 Nov 2001 21:17:17 +0100
To: submit@bugs.debian.org
Subject: ITP: ghemical -- A GNOME molecular modelling environment
Message-ID: <20011126211717.A27752@Blackbird>
Mime-Version: 1.0
Content-Type: text/plain; charset=us-ascii
Content-Disposition: inline
User-Agent: Mutt/1.3.23i
X-Debbugs-CC: debian-devel@lists.debian.org
From: Michael Banck <mbanck@gmx.net>
Delivered-To: submit@bugs.debian.org
Package: wnpp
Severity: wishlist
License: gpl
Url: http://people.debian.org/~mbanck/debs
Upstream: http://www.uku.fi/~thassine/ghemical
Description: A GNOME molecular modelling environment
Ghemical is a computational chemistry software package written in C++.
It has a graphical user interface and it supports both quantum-
mechanics (semi-empirical) models and molecular mechanics models.
Geometry optimization, molecular dynamics and a large set of
visualization tools using OpenGL are currently available.
.
Ghemical relies on external code to provide the quantum-mechanical
calculations. Semi-empirical methods MNDO, MINDO/3, AM1 and PM3 come
from the MOPAC7 package (Public Domain), and are included in the
package.
.
The project started as a freeware molecular modelling package, but
since the graphical user interface part of the package is quite
advanced and clearly written (according to our own biased view, at
least), the package now aims to become a common framework for molecular
modelling programs generally.
If nobody objects, I will upload ghemical_0.81-1 in a couple of days.
Michael
---------------------------------------
Received: (at 121296-close) by bugs.debian.org; 4 Dec 2001 20:16:09 +0000
>From troup@auric.debian.org Tue Dec 04 14:16:09 2001
Return-path: <troup@auric.debian.org>
Received: from auric.debian.org [206.246.226.45] (mail)
by master.debian.org with esmtp (Exim 3.12 1 (Debian))
id 16BLz7-000111-00; Tue, 04 Dec 2001 14:16:09 -0600
Received: from troup by auric.debian.org with local (Exim 3.12 1 (Debian))
id 16BLkW-0001Jm-00; Tue, 04 Dec 2001 15:01:04 -0500
From: Michael Banck <mbanck@gmx.net>
To: 121296-close@bugs.debian.org
X-Katie: $Revision: 1.66 $
Subject: Bug#121296: fixed in ghemical 0.81-1
Message-Id: <E16BLkW-0001Jm-00@auric.debian.org>
Sender: James Troup <troup@auric.debian.org>
Date: Tue, 04 Dec 2001 15:01:04 -0500
Delivered-To: 121296-close@bugs.debian.org
We believe that the bug you reported is fixed in the latest version of
ghemical, which has been installed in the Debian FTP archive:
ghemical_0.81-1.diff.gz
to pool/main/g/ghemical/ghemical_0.81-1.diff.gz
ghemical_0.81-1.dsc
to pool/main/g/ghemical/ghemical_0.81-1.dsc
ghemical_0.81-1_i386.deb
to pool/main/g/ghemical/ghemical_0.81-1_i386.deb
ghemical_0.81.orig.tar.gz
to pool/main/g/ghemical/ghemical_0.81.orig.tar.gz
A summary of the changes between this version and the previous one is
attached.
Thank you for reporting the bug, which will now be closed. If you
have further comments please address them to 121296@bugs.debian.org,
and the maintainer will reopen the bug report if appropriate.
Debian distribution maintenance software
pp.
Michael Banck <mbanck@gmx.net> (supplier of updated ghemical package)
(This message was generated automatically at their request; if you
believe that there is a problem with it please contact the archive
administrators by mailing ftpmaster@debian.org)
-----BEGIN PGP SIGNED MESSAGE-----
Hash: SHA1
Format: 1.7
Date: Sat, 24 Nov 2001 08:54:38 +0100
Source: ghemical
Binary: ghemical
Architecture: source i386
Version: 0.81-1
Distribution: unstable
Urgency: low
Maintainer: Michael Banck <mbanck@gmx.net>
Changed-By: Michael Banck <mbanck@gmx.net>
Description:
ghemical - A GNOME molecular modelling environment
Closes: 121296
Changes:
ghemical (0.81-1) unstable; urgency=low
.
* Initial Release; closes: #121296
* No mpqc-support yet, ghemical needs to be ported to mpqc-2.0.0
Files:
b09c726f262f959ec8ef80eba25f942c 650 science optional ghemical_0.81-1.dsc
fd59a119b5e2397928962cff79d7ecc3 1579384 science optional ghemical_0.81.orig.tar.gz
b2ff818ea9879c817f98b569814e553a 3242 science optional ghemical_0.81-1.diff.gz
9260556b85b49b2ddcd54b4f1d787133 1153702 science optional ghemical_0.81-1_i386.deb
-----BEGIN PGP SIGNATURE-----
Version: GnuPG v1.0.6 (GNU/Linux)
Comment: For info see http://www.gnupg.org
iD8DBQE8BmV3mHaJYZ7RAb8RAv/KAKC0+RR1gRqjNRP4hlaZ32Z2suBnUQCeLMc1
QdXaBvJoJkDKtsZTV3/T3UA=
=1EKe
-----END PGP SIGNATURE-----
Reply to: