GUI for fitting 3D single-molecule images using the double-helix PSF
Spectroscopy Viewer
CueMol - Molecular Visualization Framework
A library to easily analyse output of the Heidelberg MCTDH code
Generating cells for electronic structure calculations from CIF files
Simple colored and interactive Periodic Table of Elements
OpenGrowth is a program which constructs de novo ligands for proteins.
Direct Simulation Monte Carlo (DSMC) Simulator
Modern library for chemistry file reading and writing
A software package for fullerenes and their functionalized derivatives
A fast and versatile molecular dynamics program
Collaborative Computing Project for NMR (CCPN)
Sample code for Ocean Optics OmniDriver spectrometer device driver
Simulation of EPR spectra of nitroxide biradicals
PYthon eXtension for Ab Initio Dynamics
Analyze molecular simulation data