Directory of Prediction Software Resources

Home > Science > Chemistry > Nuclear Magnetic Resonance > Software > Prediction Software

Resources in This Category

• BioMagResBank

  http://www.bmrb.wisc.edu/
  Repository for data from NMR spectroscopy on proteins, peptides, and nucleic acids.

• Chemical shifts for deuterated solvents

  http://www.chem.ucla.edu/~bacher/General/30BL/NMR/deuterosolvents.html
  A table.

• Gaussian Inc.

  http://www.gaussian.com/
  Gaussian structure calculation software for your PC.

• H1 Prediction

  http://www.colby.edu/chemistry/NMR/H1pred.html
  WEB based prediction of proton chemical shifts.

• MEXICO 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

• Modgraph Consultants Ltd.

  http://www.modgraph.co.uk/index.htm
  Extensive data base of compounds and NMR prediction software.

• Predicting NMR Spectra

  http://www.acdlabs.com/products/adh/nmr/nmr_pred/
  Advanced Chemistry Development offers the industry standard HNMR, CNMR, XNMR, and 2D NMR prediction software and databases.

• ScienceSoft'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.

 

Home > Science > Chemistry > Nuclear Magnetic Resonance > Software > Prediction Software

 

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