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 DIRECTORY/Science/Tech/Chemistry/Nuclear Magnetic Resonance/Software/Prediction Software (10)
i0BioMagResBank - http://www.bmrb.wisc.edu/ - Repository for data from NMR spectroscopy on proteins, peptides, and nucleic acids.
 
i0Chemical shifts for deuterated solvents - http://www.chem.ucla.edu/~bacher/General/30BL/NMR/deuterosolvents.html - A table.
 
i0Gaussian Inc. - http://www.gaussian.com/ - Gaussian structure calculation software for your PC.
 
i0H1 Prediction - http://www.colby.edu/chemistry/NMR/H1pred.html - WEB based prediction of proton chemical shifts.
 
i0HyperNMR - http://www.hallogram.com/science/hypernmr/index.html - Commercial program for a priori prediction of one-dimensional NMR spectra
 
i0MEXICO and MEX - 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 systems
 
i0ModelFree - 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.
 
i0Modgraph Consultants Ltd. - http://www.modgraph.co.uk/index.htm - Extensive data base of compounds and NMR prediction software.
 
i0Predicting NMR Spectra - 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.
 
i0ScienceSoft's NMR Software Site - http://www.sciencesoft.net/ - Automated optimization and analysis of multi-dimensional Nuclear Magnetic Resonance spectra using NMRanalyst, AssembleIt, LockIt, and ShimIt.
 
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