Difference between revisions of "Submission NMReDATA"
From NMReDATA
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NMR records can be generated by the following software: | NMR records can be generated by the following software: | ||
| − | Bruker CMCse. | + | Bruker CMCse. |
NMR records generation is annonced for the following software: | NMR records generation is annonced for the following software: | ||
| − | Mestrelab Mnova | + | Mestrelab Mnova |
| − | ACD/Lab. software | + | ACD/Lab. software |
A script written for Mac converting Mnova files to nmredata.sdf files and generating NMR records (when the spectral data are at their original locations) was written by Damien Jeannerat and [https://github.com/NMReDATAInitiative/Mnova_export_script available on github]. If is probably also working on linux systems. It requires Mnova to be installed because it relies on Mnova script for the generation of the NMReDATA. | A script written for Mac converting Mnova files to nmredata.sdf files and generating NMR records (when the spectral data are at their original locations) was written by Damien Jeannerat and [https://github.com/NMReDATAInitiative/Mnova_export_script available on github]. If is probably also working on linux systems. It requires Mnova to be installed because it relies on Mnova script for the generation of the NMReDATA. | ||
Revision as of 16:35, 19 December 2017
When possible, authors should submit NMR Records for all assigned compounds.
NMR records can be generated by the following software:
Bruker CMCse.
NMR records generation is annonced for the following software:
Mestrelab Mnova ACD/Lab. software
A script written for Mac converting Mnova files to nmredata.sdf files and generating NMR records (when the spectral data are at their original locations) was written by Damien Jeannerat and available on github. If is probably also working on linux systems. It requires Mnova to be installed because it relies on Mnova script for the generation of the NMReDATA.
