Predicting NMR Spectra - Advanced Chemistry Development offers the industry standard HNMR, CNMR, XNMR, and 2D NMR prediction software and databases.HyperNMR - Commercial program for a priori prediction of one-dimensional NMR spectra
MEXICO and MEX - Chemical Exchange Lineshape Software. This is a set of programs for calculating the lineshapes in both coupled and uncoupled spin systems
SHIFTY - A web based chemical shift predictor for 1H, 13C and/or 15N chemical shifts of proteins and peptides.
Gaussian Inc. - Gaussian structure calculation software for your PC.
ModelFree - ModelFree is a program for optimizing "Lipari-Szabo model free" parameters to heteronuclear relaxation data.
H1 Prediction - WEB based prediction of proton chemical shifts.
Advanced Chemistry Development - Fluorine and phosphorus NMR database and prediction
