C++ code for object-oriented formulation of scientific experiments
Time-dependent simulation of open and closed quantum systems
Print Steam Tables; Plot diagrams and cycles from equations of state
Libraries and scripts for molecular modelling written in Perl
A web database for experimental results of research
CueMol - Molecular Visualization Framework
PYthon eXtension for Ab Initio Dynamics
A Python based command line math utility.
Comprehensive thermal analysis software package
small and smart peptide array generator, considering time complexity.
ISL Solid-Liquid Equilibrium Calculator
nwbas2ecce converts nwchem basis set files to the ECCE format
A C library to handle compositional (=closed) data, like proportions.