View, manipulate, analyze (LS fit, SVD, FT), and make figs of, spectra
Easy manipulation of sdf molecular data files.
Analysis of Raman spectra and spectroscopy data.
General purpose de novo molecular design software
Visualization of wavefunctions calculated by VASP (New release: v0.41)
user-friendly access to the latest computational spectroscopy tools
Software for Introductory Chemical Engineering Thermodynamics
NMR Product Operator Calculator
A simple molecular weight calculator
Open source electronic lab notebook (ELN) for scientists
Where SPM images and molecular models meet
Libraries and scripts for molecular modelling written in Perl
A web database for experimental results of research
MALDI-TOF data analysis tool
controls high-temperature single-crystal XRD experiments using IPDSII