Sponsored Links:
Roland Stenutz's Homepage (Popularity:  )
http://www.kemi.slu.se/~stenutz/
A few nice Karplus and Pachler calculators. Downloadable
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Mathcad (Popularity: )
http://science.widener.edu/svb/nmr/mcad_nmr.html
Documents for Teaching NMR
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IUNMR Software (Popularity: )
http://nmr.chem.indiana.edu/software.html
Software developed for NMR at IU
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Babel - A Molecular Structure Information Interchange Hub (Popularity: )
http://smog.com/chem/babel/
A program designed to interconvert a number of file formats currently used in molecular modeling.
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VINCE (Popularity: )
http://www.rowland.org/rnmrtk/vince.html
A Program for Displaying Protein NOE Data
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Advanced Chemistry Development (Popularity: )
http://www.acdlabs.com/
Provides a wide set of desktop and on-line software for chemists and educators: NMR, IR, UV, MS, drawing and modelling, ...
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IBS: LRMN Software Developments (Popularity: )
http://www.ibs.fr/ext/labos/LRMN/softs/welcome.htm
Software: CURVE3D, visualisation of 3D surface. TENSOR, determination of the rotational diffusion tensor
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GAMMA (Popularity: )
http://gamma.ethz.ch/
C++ library for simulation of Magnetic Resonance experiments.
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Wuthrich group NMR software (Popularity: )
http://www.mol.biol.ethz.ch/groups/wuthrich_group/software
A list of various software packages including: ATNOS, AUTOPSY, GARANT, MOUMOL, RADAR, and XEASY
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Software packages developed at the CMRR (Popularity: )
http://www.cmrr.umn.edu/downloads/index.shtml
Stimulate - multifunctional image analysis tool, PhysioFix - adjust for respiration and cardio effects, PhysioFix for Matlab, Cluster_prob - clustered ...
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Chemical shift (J) to Dihedral angle converter (Popularity: )
http://www.jonathanpmiller.com/Karplus.html
This is a web-based program that converts the chemical shift from NMR spectra to the dihedral (torsional) angle to assist ...
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HyperNMR (Popularity: )
http://www.hallogram.com/science/hypernmr/index.html
Commercial program for a priori prediction of one-dimensional NMR spectra
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MEXICO and MEX (Popularity: )
http://www.chemistry.mcmaster.ca/~bain/mexmanc.html
Chemical Exchange Lineshape Software. This is a set of programs for calculating the lineshapes in both coupled and uncoupled spin ...
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Gaussian Inc. (Popularity: )
http://www.gaussian.com/
Gaussian structure calculation software for your PC.
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ModelFree (Popularity: )
http://cpmcnet.columbia.edu/dept/gsas/biochem/labs/palmer/software/modelfree.html
ModelFree is a program for optimizing "Lipari-Szabo model free" parameters to heteronuclear relaxation data.
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H1 Prediction (Popularity: )
http://www.colby.edu/chemistry/NMR/H1pred.html
WEB based prediction of proton chemical shifts.
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BioMagResBank (Popularity: )
http://www.bmrb.wisc.edu/
Repository for data from NMR spectroscopy on proteins, peptides, and nucleic acids.
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Chemical shifts for deuterated solvents (Popularity: )
http://www.chem.ucla.edu/~bacher/General/30BL/NMR/deuterosolvents.html
A table.
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Predicting NMR Spectra (Popularity: )
http://www.acdlabs.com/products/spec_lab/predict_nmr/
Advanced Chemistry Development offers the industry standard HNMR, CNMR, XNMR, and 2D NMR prediction software and databases.
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DASHA (Popularity: )
http://www.nmr.ru/dasha.html
is an program designed to investigate dynamics of biomolecules, for which data of N-15 or C-13 heteronuclear relaxation are available.
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