Virtual Screening software for Computational Drug Discovery
2D molecule editor
High-performance read alignment, quantification and mutation discovery
MzDOCK is A Virtual Screening Tool For Drug Discovery Research
Processing and analysis of Small Angle X-ray Scattering (SAXS) data.
ShelXle is a Qt GUI for SHELXL
Molecular dynamics by NMR data analysis
Software for molecular simulations and trajectory analysis
Program for the analysis of spectroscopic data, in particular EPR(ESR)
Approximate solvation free energy calculator
Generation of molecular formulas by high-resolution MS and MS/MS data
Software for analysis of patch-clamp recordings and other wave data
Open-source online virtual screening tools for large databases
The BMRB library
Differential Evolution Entirely Parallel Method
View, manipulate, analyze (LS fit, SVD, FT), and make figs of, spectra
Alignment of tilt-series TEM images based on faint fiducial markers
Java science library.