Provides a wide set of desktop and on-line software for chemists and educators: NMR, IR, UV, MS, drawing and modelling, chromatography, naming, comprehensive databases and predicti...
http://www.acdlabs.com/
This is a web-based program that converts the chemical shift from NMR spectra to the dihedral (torsional) angle to assist in molecular modelling which uses the Karplus equations to...
http://www.jonathanpmiller.com/Karplus.html
The Dmfit programs enables fitting of solid state (and liquid) NMR spectra, including 1D and 2D datasets. Edit NMR program : file Viewer for NMR files.
http://crmht-europe.cnrs-orleans.fr/dmfit/
Software: CURVE3D, visualisation of 3D surface. TENSOR, determination of the rotational diffusion tensor
http://www.ibs.fr/ext/labos/LRMN/softs/welcome.htm
A large and useful list of NMR software, processing, assignment, and simulation. From University of Potsdam.
http://www.chem.uni-potsdam.de/linkcenter/nmrsoft.html
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