ARGO is a program for analysis of electronic structure calculations
software for DFA method
Water & steam properties Java library
Open source software to fit Xray photoelectron spectroscopy (XPS) data
Applications for data management
Dynamics of quantum systems, controlled by external fields
Print Steam Tables; Plot diagrams and cycles from equations of state
molecular editor and viewer
Toxicity prediction for chemical compounds
user-friendly access to the latest computational spectroscopy tools
Software for Introductory Chemical Engineering Thermodynamics
Open Source Web Based LIMS for analytical laboratory
a Toolset for Molecular Mechanical Force Field Parameterization
GUI for MOPAC, DFTB+, GAMESS, Firefly, NWChem, ORCA and PSI4
(Q)SAR Model Reporting Format Inventory
OpenGrowth is a program which constructs de novo ligands for proteins.
Modern library for chemistry file reading and writing
Sample code for Ocean Optics OmniDriver spectrometer device driver
An intuitive molecular editor and visualization tool
LC-MS/MS data browser designed for siderophore analysis