Simulate chemical processes using advanced thermodynamic models
macOS version of the USGS geochemical modeling code PHREEQC
Chemical structures database & machine learning with web services API
A Raman spectra library with search and storage function.
Applications for data management
An Open Source "product catalogue" that is customizable and versatile.
Nonpolar Surface Area from Continuum Solvation
Open Source Web Based LIMS for analytical laboratory
A web database for experimental results of research
Exploring chemical similarity
(Q)SAR Model Reporting Format Inventory
Generating cells for electronic structure calculations from CIF files
LC-MS/MS data browser designed for siderophore analysis