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Review API for automatic generation of NMR #10

Open mariliava opened 2 years ago

mariliava commented 2 years ago

Renew ACD/Labs collaboration and leave the system active for when we insert new compounds, generate the spectra automatically

Show the spectrum in each search result compound, with a dynamic spectrum, zoom possibility such as:(http://www.hmdb.ca/spectra/nmr_one_d/2057). Showing peak picking and constant tables

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In search, in the filters by NMR, put "i" (for information) and the text appears: "NMR data is predicted using ACD Labs software NMR Predictors Batch. Solvent is undefined and 600MHz for 1H and 150MHz for 13C. Search shifts using separator “;”"

in search, in the NMR filter, allow it to be searched in 1H and 13C by several chemical shifts, separated by some separator (;) and inform the user in (i) which separator.