Top Tweets for #NPAtlas

about 3 years ago

I'm struggling with the substructure search of #NPAtlas. For example, how can I find NPs that contain 2,3-DHB while excluding other benzoate substitutions? Adding explicit hydrogens doesn't seem to work either. @NatProdAtlas

ZachReitzPhD's tweet photo. I'm struggling with the substructure search of #NPAtlas. For example, how can I find NPs that contain 2,3-DHB while excluding other benzoate substitutions? Adding explicit hydrogens doesn't seem to work either. @NatProdAtlas https://t.co/mF7zfhj0Cl

Eleonora Nigro @nigrelex

over 4 years ago

Roger Linington talking about #npatlas at @novonordiskfond That’s A lot of work to do cross linking with different databases! Thanks a lot! ☺️ #data #mining #molecules #atlas #database

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