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This page allows to predict the spectrum from the chemical structure based on 'Spinus'. You may find more information on the authors website.Mestrenova Nmr Prediction
References
- MestReC Cheat Sheet by Monika Ivancic, July 1st2005 This Cheat Sheet is to be used at UW-Madison as a quick guide to processing using the MestReC NMR software. You may find more help at the MestReC homepage (www.mestrec.com) or by clicking on ‘help’ (F1) in the MestReC program.
- MestReNova (Mnova) is the latest Nuclear Magnetic Resonance & LC/GC/MS data processing, visualization, simulation, prediction, presentation and analysis software package available on the market. MestReNova (Mnova) is the natural evolution of the very popular application MestReC.
MestReNova is a Windows utility built specifically for helping you analyze chemistry data in a multiplatform environment. Thanks to its plugin support, you can process, visualize, simulate,.
- Banfi, D.; Patiny, L. www.nmrdb.org: Resurrecting and processing NMR spectra on-lineChimia, 2008, 62(4), 280-281.
- Andrés M. Castillo, Luc Patiny and Julien Wist. Fast and Accurate Algorithm for the Simulation of NMR spectra of Large Spin Systems.Journal of Magnetic Resonance2011.
- Aires-de-Sousa, M. Hemmer, J. Gasteiger, “Prediction of 1H NMR Chemical Shifts Using Neural Networks”, Analytical Chemistry, 2002, 74(1), 80-90 most of the proton descriptors are explained. In that work they were used for the prediction of 1H NMR chemical shifts by counterpropagation neural networks.
We thanks Molecular Networks for providing the predicting engine.
MestReNova (Mnova) is the latest Nuclear Magnetic Resonance & LC/GC/MS data processing, visualization, simulation, prediction, presentation and analysis software package available on the market.
MestReNova (Mnova) is the natural evolution of the very popular application MestReC. Whilst including all the NMR processing and analysis functionality present in MestReC, it is a completely new development and a completely new concept which will open up a whole new range of possibilities when storing and sharing data within organizations, changing the way in which scientists process and report NMR and LC/GC/MS data. Mnova has been designed to make NMR and LC/GC/MS both more convenient and more powerful, and to give the user improved results with minimum effort.
The program provides a variety of conversion facilities for most NMR and LC/GC/MS spectrometer and chromatogram formats and includes all the conventional processing, displaying, and plotting capabilities of an NMR program, as well as more advanced processing techniques with a very user friendly graphical interface.
Features:
NINE PLUG-INS
Mnova has been split into two different basic plugins: Mnova NMR and Mnova MS. In addition, Mnova can run a number of additional advanced modules such as mixtures analysis, reaction monitoring, quantitation, chemical shift prediction, screening, verification as well as physico-chemical properties prediction.
WORKFLOW OPTIMIZATION
Excellent ability to manually interact with your data as well as to prepare an automated workflow to save your precious time.
ONE SHARED INTERFACE
Mnova combines all your analytical data within the same software interface. This is a time saver and a very efficient way to process, analyze and report your data.
SCRIPTING ENGINE
Perform any action available in the Mnova graphical user interface but in full automation. Our developers have created big projects using our scripting engine and we can help your business if you have specific needs.
ONE CORE APPLICATION
Mnova enables you to increase your productivity by combining your analytical data in one piece of software. Advanced algorithmia runs in the background to provide quality results.
EASIER LEARNING CURVE
Bringing all your analytical data into one single interface (powerpoint look) makes Mnova a piece of software with an extremely quick rate of learning.
DOWNLOAD
NFO
1. Install the 32bit program MestReNova-14.2.0-26256.msiMestrec Nmr Software
2. unzip crack.zip into the program folder and overwrite MestReNova.exeMestrec Nmr Software
3. Install Advanced plugins from menu 'Edit' - 'Advanced Plug-ins'
Mestrec Nmr Software Download
Windows, Tools