ghemical 3.0.0-4 source package in Ubuntu
Changelog
ghemical (3.0.0-4) unstable; urgency=medium * Team upload. * Point Vcs fields to Salsa. * debhelper 11 * Standards-Version: 4.3.0 * Remove trailing whitespace in debian/changelog * Do not parse d/changelog -- Andreas Tille <email address hidden> Wed, 02 Jan 2019 15:15:34 +0100
Upload details
- Uploaded by:
- Debichem Team
- Uploaded to:
- Sid
- Original maintainer:
- Debichem Team
- Architectures:
- any
- Section:
- gnome
- Urgency:
- Medium Urgency
See full publishing history Publishing
Series | Published | Component | Section |
---|
Downloads
File | Size | SHA-256 Checksum |
---|---|---|
ghemical_3.0.0-4.dsc | 2.1 KiB | 47f92d3450c72cc576693ce90f45b5f93a47ef903f7f5d2a31ba67183becf0dc |
ghemical_3.0.0.orig.tar.gz | 2.1 MiB | babb2bda93cf0c20f234452eeb7d19d1d8c0e4c4d611734f110f8de066a1bcb2 |
ghemical_3.0.0-4.debian.tar.xz | 18.9 KiB | acd4225da14be017a380a9eccb65e0b8a52da24ef965682ee5b758451ed54405 |
Available diffs
No changes file available.
Binary packages built by this source
- ghemical: 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 MPQC package is used to provide ab initio methods: the
methods based on Hartree-Fock theory are currently supported with
basis sets ranging from STO-3G to 6-31G**.
- ghemical-dbgsym: No summary available for ghemical-dbgsym in ubuntu eoan.
No description available for ghemical-dbgsym in ubuntu eoan.