The General Atomic and Molecular Electronic Structure System (GAMESS) is a free and open source general ab initio quantum chemistry package.
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MPQC – Massively Parallel Quantum Chemistry software
MPQC (Massively Parallel Quantum Chemistry Program) is software that computes properties of atoms and molecules from first principles.
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NWChem – chemistry software
NWChem is an ab initio computational chemistry software package that is suitable to perform complex calculations on molecular structure.
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Avogadro – advanced molecule editor and visualizer
Avogadro is an advanced open source molecular editor designed for cross-platform use in computational chemistry, and other areas.
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PyMOL – molecular visualization system software
PyMOL is a molecular graphics system designed for real-time visualization and molecular graphics images and animations.
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CP2K – atomistic simulations of solid state, liquid, molecular and biological systems
CP2K is a free and open source quantum chemistry and solid state physics software package that can perform atomistic simulations.
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Open Babel – chemical toolbox software
Open Babel is a version of the Babel chemistry file translation program. Convert, analyze, or store data from molecular modeling.
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Gabedit – GUI to computational chemistry packages
Gabedit is a graphical user interface to Gamess-US, Gaussian, Molcas, Molpro, MPQC, PCGamess and Q-Chem computational chemistry packages.
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Jmol – viewer for chemical structures in 3D
Jmol is a Java viewer for three-dimensional chemical structures with features for chemicals, crystals, materials and biomolecules.
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Kalzium – periodic system of the elements
Kalzium is a chemistry application for KDE 5, including a Periodic Table of Elements, chemical reference, chemical equation solver, and more.
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XDrawChem – molecule structure drawing
XDrawChem is a 2D editor for chemical structures and reactions. It mirrors the abilities of the commercial ChemDraw suite.
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MoleQueue – abstract, manage, and coordinate the execution of tasks
MoleQueue is a C++ desktop application for abstracting, managing, and coordinating the execution of tasks.
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BKChem – chemical drawing program
BKChem is a free and open source 2D molecule editor written in Python. It has a wealth of features but is simple to use.
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HexChat – GTK+ IRC client based on XChat
HexChat is an open source, feature-rich, multi-network IRC client based on XChat.It offers a wide range of features.
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Quassel IRC – distributed IRC client
Quassel IRC is a modern, cross-platform, distributed Internet Relay Chat (IRC) client based on the Qt5 framework.
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Smuxi – IRC client
Smuxi is an Irssi-inspired, flexible, user-friendly and cross-platform IRC client for sophisticated users, targeting the GNOME desktop.
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Pidgin – multi-protocol instant messaging client
Pidgin is an open source graphical Instant Messenger (IM) program that lets you sign on to many chat services.
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KVIrc – Qt-based IRC client
KVIrc is a free and open source cross-platform Internet Relay Chat client. The name stands for K Visual Internet Relay Chat client.
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Konversation – IRC client for KDE
Konversation is an Internet Relay Chat (IRC) client for the KDE (K Desktop Environment). It’s built on Qt and KDE Frameworks 5.
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Polari – IRC client for GNOME desktop environment
Polari is an open source IRC client for the GNOME desktop environment. It enables users to chat with people around the world.
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