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chemosim-lab / M2OR

Molecule to Olfactory Receptor (M2OR) dataset
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Data? #1

Closed rick-osmo closed 1 year ago

rick-osmo commented 1 year ago

Hi,

I spoke with you at your poster at AChemS. Will the data for M2OR be put into this repository?

Maxence-Lalis commented 1 year ago

Hello,

Data is now available and named “M2OR_20230428.csv”. I will add more and update the repo in the near future.

seyonechithrananda commented 1 year ago

Do you know where we can find the post-processed, binarized data (accounting for different types of experiments for each pair, etc) used to train the protein-ligand model?

seyonechithrananda commented 1 year ago

^ i've looked through the raw data and have a vague understanding of how the filtering was done, but was wondering if there was a frozen post-processed dataframe of mol-OR pairs for the 04/28/23 data release?

MatejHl commented 4 months ago

Hello all,

I come back to this thread in case someone will come to look for the data through here.

The most up-to-date data are available on the M2OR website: https://m2or.chemsensim.fr/ This repository will be updated with (possibly large) delay, so preferably check the data on the website which is up to date.

I wish you a happy research! Matej