ghemical 3.0.0-3 source package in Ubuntu


ghemical (3.0.0-3) unstable; urgency=medium

  * Team upload.
  * Moved packaging from SVN to Git
  * cme fix dpkg-control
  * DEP5

 -- Andreas Tille <email address hidden>  Thu, 07 Dec 2017 16:14:00 +0100

Upload details

Uploaded by:
Debichem Team on 2017-12-07
Uploaded to:
Original maintainer:
Debichem Team
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Bionic release on 2017-12-08 universe gnome


File Size SHA-256 Checksum
ghemical_3.0.0-3.dsc 2.1 KiB e776b060dfa30e31d2895c0d3dbf8c575dbb868c8cdd283610fef35c948c7c35
ghemical_3.0.0.orig.tar.gz 2.1 MiB babb2bda93cf0c20f234452eeb7d19d1d8c0e4c4d611734f110f8de066a1bcb2
ghemical_3.0.0-3.debian.tar.xz 18.8 KiB 2389039cd570fa1df47044b9b8150ef32a1ad351b183eb2e8eb99c89bb92360c

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: debug symbols for ghemical