Virtual Screening software for Computational Drug Discovery
MzDOCK is A Virtual Screening Tool For Drug Discovery Research
Processing and analysis of Small Angle X-ray Scattering (SAXS) data.
2D molecule editor
molecular editor and viewer
ShelXle is a Qt GUI for SHELXL
Open-source cross-platform spectrometer device driver
- RetroScheme is used for molecule sketching and retrosynthesis
Molecular dynamics by NMR data analysis
Program for the analysis of spectroscopic data, in particular EPR(ESR)
Molecule Sketcher and Immediate Parser to Excel, .SMI and 3D SDF
Program for molecular graphics
Time-dependent simulation of open and closed quantum systems
Software for analysis of patch-clamp recordings and other wave data
Calculate growth rates from microplate reader output
RDkit-based Molecule Optimization Tool (CLI) in python.
Java science library.