Welcome to the CSEARCH / NMRPREDICT-Server
NMR-Summerschool at Niederöblarn, Sep 14-19, 2014
The Austrian Way of University Funding
(seen on April 2nd, 2014 in „Salzburger Nachrichten“)
Forschung und Leere …..
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CSEARCH-Derived Web-Services
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Peer-Reviewing of Carbon-NMR-Spectra Registration via email to Wolfgang.Robien[at]univie.ac.at is necessary before first usage |
CSEARCH-Robot-Referee (Java-Version) CSEARCH-Robot-Referee (Javascript-Version) |
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Status of the CSEARCH-Robot-Referee |
Information about the CSEARCH-Robot-Referee Information about scheduled maintenance |
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A few 'Highlights' of assignment errors as found in the literature |
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Spectral similarity-search based on 16,4 millions predicted CNMR-spectra calculated for the PUBCHEM-structures including ranking of resulting hitlist |
Spectral similarity search with ranking 16,4 millions of predicted CNMR-spectra |
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Spectral similarity-search based on 71 millions predicted CNMR-spectra calculated for the PUBCHEM-structures without ranking of the resulting hitlist |
Spectral similarity search without ranking 71 millions of predicted CNMR-spectra / Pattern search |
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Spectral similarity-search based on 48 millions predicted CNMR-spectra calculated for the PUBCHEM-structures with ranking, separate deviation for every shiftvalue and unknown multiplicities possible |
Spectral similarity search with ranking – latest version Test-version: Feedback highly appreciated 48 millions of predicted CNMR-spectra |
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Upgrade of CSEARCH-Databases including literature citations |
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Searching for experimental C,P,F,N,O,B,Si-spectra available in a large variety of database- and prediction-programs |
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Searching for existing experimental spectral data automatically from other programs |
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Cooperation partners using CSEARCH-data and/or CSEARCH-technology |
MestReNova / NMRPredict&Mnova Verify
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Page written by: Wolfgang.Robien(-at-)univie.ac.at
Page written on: January 18th, 2014
Last update on: April 2nd, 2014