Free Nmr Software For Mac
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MestReC is a multipage, multivendor, multitechnique and multiplatform analytical chemistry software suite designed as a container for our NMR & MS plugins. You may want to check out more software, such as TerraExplorer, GraphCalc or 3D World Map, which might be similar to MestReC. Advanced prediction, processing, and interpretation software for nuclear magnetic resonance spectroscopy. ACD/NMR Predictors. Quickly and accurately predict 1D and 2D NMR spectra, chemical shifts, and coupling constants for 1 H, 13 C, 15 N, 19 F, 31 P nuclei. The highly accurate algorithms can be further trained with additional user data for customized performance.
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Since many people appear to be searching the site for spectroscopy applications I thought I'd compile a list. Remember that many of the more expensive applications have free/cheap education or student versions.
Click on the table headers to sort.| Application | Price | Link | Notes | Updated |
|---|---|---|---|---|
| iNMR5.3.6 | €300 | http://www.inmr.net/ | Several licensing options, specifically written for MacOSX, with spotlight and quicklook plugins. Now linked to DOSY toolbox | 06/05/2014 |
| iNMR Reader | €30 | http://www.inmr.net/ | Similar to iNMR without 'save' option | 25/10/2007 |
| ARIA2 | $0 | http://aria.pasteur.fr | (Ambiguous Restraints for Iterative Assignment) is a software for automated NOE assignment and NMR structure calculatio | 25/05/2017 |
| INSENISITIVE | $0 | https://sourceforge.net/projects/insensitive/ | Insensitive (Incredible Nuclear Spin EvolutioN SImulation Tool Intended for Visual Education) | 10/08/18 |
| NMRpipe | $0 | http://spin.niddk.nih.gov/bax/software/NMRPipe/ | NMRPipe is a collection of UNIX-based programs for multidimensional spectral processing and analysis | 25/10/2007 |
| NMRpipe | $0 | http://spin.niddk.nih.gov/bax/software/NMRPipe/ | NMRPipe is a collection of UNIX-based programs for multidimensional spectral processing and analysis | 25/10/2007 |
| NMRViewJ | $0, paid support | http://www.onemoonscientific.com/nmrview/ | NMRView is a program for the visualization and analysis of NMR datasets | 25/10/2007 |
| NMRnotebook | €700 | http://www.nmrtec.com | NMRnotebook is especially designed for chemists, biochemists and spectroscopists dealing with NMR.It allows you to perform state of the art 1D and 2D NMR data processing by just a few mouse clicks | 25/10/2007 |
| Mnova | €1175 | http://www.mestrec.com/ | Several licensing options, NMR processing, analysis and simulation | 25/10/2007 |
| Mnova Lite | €490 | http://www.mestrec.com/ | 1D processing only | 29/04/2009 |
| Chenomx | ?? | http://www.chenomx.com/products/ | Free Evaluation, NMR processing, analysis and simulation | 12/01/2008 |
| mMass | $0 | http://www.mmass.org/ | Open source Mass Spectrometry Tool. | 02/04/2008 |
| Peacock | ?? | http://www.johankool.nl/software/peacock/ | Used to interpret gas-chromatography/mass-spectrometry (GC/MS) data files. | 02/04/2008 |
| CNMRazor | $0 | http://www.cnmrazor.com/ | 13C virtual spectrometer. | 10/06/2008 |
| HNMRazor | $0 | http://www.hnmrazor.com/ | 1H virtual spectrometer. | 10/06/2008 |
| Sweet J | $0 | http://www.inmr.net/sweetj.html/ | A Desktop Calculator for the Karplus Equation. | 1/04/2009 |
| CARA | $0 | http://www.nmr.ch/ | NMR spectra and computer aided resonance assignment | 26/04/2009 |
| MSpin | $700 | http://www.mestrec.com/index.php?idp=2&i18n=1 | Compute Scalar Coupling Constants, NOE intensities and Residual Dipolar Coupling Constants | 29/04/2009 |
| CcpNmr Suite | $0 | http://www.ccpn.ac.uk/ccpn/software/ccpnmr-suite/ | A series of programs for macromolecular NMR spectroscopy | 01/04/2010 |
| NPK | $0 | http://abcis.cbs.cnrs.fr/NPK/index.html | NMR processing program | 01/04/2010 |
| MassXpert | $0 | http://www.massxpert.org/wiki/ | Mass Spec program | 12/07/2011 |
| xhromatogram | $0 | http://www.mt-se.com/xhr_1.html | Mass Spec and chromatograpy data viewer | 17/04/2010 |
| NMRShiftDB | $0 | http://nmrshiftdb.nmr.uni-koeln.de/ | Free NMR shift database | 25/04/2011 |
| OpenChrom | $0 | http://www.openchrom.net/main/content/index.php | software for chromatography and mass spectrometry | 06/06/2012 |
| Maltcms | $0 | http://maltcms.sourceforge.net/home/index.html | Modular Application Toolkit for Chromatography Mass-Spectrometry | 01/07/2012 |
| pycifrw | $0 | https://bitbucket.org/jamesrhester/pycifrw/wiki/Home | MPyCIFRW provides support for reading and writing CIF (Crystallographic Information Framework) files using Python | 22/10/2012 |
| MassXpert | $0 | http://www.massxpert.org/wiki/ | Mass Spec program | 12/07/2011 |
| Accept-NMR | $0 | http://mcdermott.chem.columbia.edu/software/ | Predict Protein NMR spectra, and specifically the positions of intermolecular contact cross-peaks, based on the contacts predicted and chemical shift table | 6/04/2013 |
| rNMR | $0 | http://rnmr.nmrfam.wisc.edu | rNMR is an add-on package developed for R | 21/03/2014 |
| CASA | $0 | http://eos.univ-reims.fr/LSD//JmnSoft/CASA/ | Assign 13C to carbon atoms in structure | 09/05/2014 |
| LSD | $0 | http://eos.univ-reims.fr/LSD/index_ENG.html | Find all possible molecular structures of an organic compound that are compatible with its spectroscopic data | 09/05/2014 |
| Topspin | $0 for education | https://www.bruker.com/nc/service/support-upgrades/software-downloads/nmr/free-topspin-processing.html | NMR processing package from Bruker | 09/05/2014 |
| r-maldiquant | $0 | https://anaconda.org/bioconda/r-maldiquant | A complete analysis pipeline for matrix-assisted laser desorption/ionization-time-of-flight (MALDI-TOF) | 05/12/2017 |
| Colvistec | $? | https://www.colvistec.de | Inline UV-Vis spectroscopy-based hardware & software solutions | 04/06/2018 |
| PythoMS | $0 | https://github.com/larsyunker/PythoMS | PythoMS: A Python framework for analysis of mass spectrometric data | 30/10/2018 |
| isicle | $0 | https://github.com/pnnl/isicle | NMR chemical shift calculations | 05/11/2018 |
There are also an increasing number of spectroscopy application available for mobile devices.
You might also be interested in the NMRwiki. NMRWiki.ORG was started on Nov 8th 2007; it is and will remain public property of NMR, ESR and MRI professionals and users. At this time NMRWiki.ORG is not affiliated with any official organization, but it is a private volunteer effort.The goal of this site is to provide a collaborative informational resource to Spectroscopists, Chemists, Biologists and others using magnetic resonance techniques. Access to the content is and will remain free of charge to anyone.
Updated 5 November 2018