Ubuntu
ghemical package

ghemical 3.0.0-5build1 source package in Ubuntu

Changelog

ghemical (3.0.0-5build1) focal; urgency=medium

  * No-change rebuild for libgcc-s1 package name change.

 -- Matthias Klose <email address hidden>  Tue, 24 Mar 2020 15:13:35 +0100

Upload details

Uploaded by:
Matthias Klose
Uploaded to:
Focal
Original maintainer:
Debichem Team
Architectures:
any
Section:
gnome
Urgency:
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Focal release universe gnome

Downloads

File Size SHA-256 Checksum
ghemical_3.0.0.orig.tar.gz 2.1 MiB babb2bda93cf0c20f234452eeb7d19d1d8c0e4c4d611734f110f8de066a1bcb2
ghemical_3.0.0-5build1.debian.tar.xz 19.6 KiB 10cffe24476ee83357929ed22691cfeb119ba97c13bbe3031556b97662439f4c
ghemical_3.0.0-5build1.dsc 2.1 KiB 225f268a7f04fa867425f8977d81e2404e5b40d01c35950ff1ea5ec38196b4b8

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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