Annotation columns for manually-curated molecules

ersilia-os / sars-cov-2-chemspace

This repository explores the chemical space associated with SARS-CoV-2 according to manually curated data at UB-CeDD

GNU General Public License v3.0

0 stars 0 forks source link

Open miquelduranfrigola opened 4 months ago

miquelduranfrigola commented 4 months ago

We need to annotate manually-curated molecules with the following information:

All of this should go in a tabular format, either produced from MOE or as a CSV file.

miquelduranfrigola commented 3 months ago

@GemmaTuron can we close this issue?

GemmaTuron commented 3 months ago

This is still being worked out by Fidele