Must have Physics & Chemistry Software for Linux
JChemPaint project is an editor for 2D molecular structures.JChemPaint is intended to be complementary to Jmol, a visualisation and analysis tool for 3D molecular structures, started by Dan Gezelter at Notre Dame University, initator of the Open Science...
Kalzium is an open source graphical application written in Qt and designed especially for the KDE Software Compilation desktop environment.Kalzium displays some information about the periodic system of the elements, and features a versatile overview...
The Marvin project offers a collection of Java tools for drawing, displaying and characterizing chemical structures, substructures and reactions.Marvin can be easily installed on your desktop and seamlessly integrated into web pages and third party...
Mychem is a chemical extension for MySQL.Mychem is an open source package providing a set of chemical functions for MySQL. These functions are designed to permit you to handle chemical data within a MySQL database.The Mychem project aims to provide a...
octopus project is a program aimed at the ab initio virtual experimentation on a hopefully ever increasing range of systems types.Electrons are describe quantum-mechanically within the Density-Functional Theory (DFT), in its time-dependent form (TDDFT)...
Open Babel is an open source, collaborative, free and multiplatform library software that has been designed to act as a chemical toolbox specially engineered to recognize numerous languages of chemical data. It is simply dubbed “The Open Chemistry...
Periodic Tables Package is an advanced suite of applications for both Windows and Linux that allow chemists and students alike to use the Periodic Table on their computers.INSTALLATION:1. `cd' to the directory containing the package's source code and type...
ProtoFit is software for modeling the acid/base behavior of surfaces. The software is used for parameterizing surface protonation models and for visualization of potentiometric titration data.ProtoFit is a tool for optimization of surface protonation...
PyVib2 is a program for analyzing vibrational motion and vibrational spectra, written in pure Python. PyVib2 project was developed by Maxim Fedorovsky during his Ph.D. thesis work in Prof. Werner Hug's research group.PyVib2 permits the automatic...
QMForge project can be used to analyze the results of quantum chemistry (DFT) calculations. Gaussian 98/03, ADF, GAMESS (US), GAMESS (UK), PC-GAMESS, Jaguar, and ORCA files are supported (see below). The following analyses are available:· Mulliken...