Vladas Oleinikovas
@oleinikovasv.bsky.social
Computational Chemist - CADD/TPD; PhD Chemistry at UCL; BA, MSci Natural Sciences, Chemistry (Cantab).
These are more reflective of counts in PDB than anything else.
If one wants a subset of ligands that fit a particular interest - lots of annotations are provided, including tutorials on how-to!
Please consider reviewing ligand stats for the actual MLSB test set (346) set of de-leaked PLI systems
If one wants a subset of ligands that fit a particular interest - lots of annotations are provided, including tutorials on how-to!
Please consider reviewing ligand stats for the actual MLSB test set (346) set of de-leaked PLI systems
December 24, 2024 at 5:19 PM
These are more reflective of counts in PDB than anything else.
If one wants a subset of ligands that fit a particular interest - lots of annotations are provided, including tutorials on how-to!
Please consider reviewing ligand stats for the actual MLSB test set (346) set of de-leaked PLI systems
If one wants a subset of ligands that fit a particular interest - lots of annotations are provided, including tutorials on how-to!
Please consider reviewing ligand stats for the actual MLSB test set (346) set of de-leaked PLI systems
📢 Join us this Friday for a talk by @jeremywohlwend.bsky.social & @gcorso.bsky.social on their recent publication of #Boltz-1 - a new #opensource SOTA model for 3D biomolecular structure prediction.
🕰️: Fri, Dec 06 - 4p CET/10a ET
🔗: genaiindrugdiscovery.com
🕰️: Fri, Dec 06 - 4p CET/10a ET
🔗: genaiindrugdiscovery.com
December 3, 2024 at 2:00 PM
📢 Join us this Friday for a talk by @jeremywohlwend.bsky.social & @gcorso.bsky.social on their recent publication of #Boltz-1 - a new #opensource SOTA model for 3D biomolecular structure prediction.
🕰️: Fri, Dec 06 - 4p CET/10a ET
🔗: genaiindrugdiscovery.com
🕰️: Fri, Dec 06 - 4p CET/10a ET
🔗: genaiindrugdiscovery.com