2024-05-15

PAMREIN's daily Open Notebook (COMMONS Lab)

Todo - Check Github

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Meetings

Daily report (What did I learn?)

Today I tried to produce MS spectras out of some SMILES. I tried RDkit, openbabel and cfmid. None of them worked in the first try. Until now, I am not sure if I am supposed to do it. But at least I try.

Future perspective

Keywords

Abbreviations