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🎊Check out our latest preprint "Assigning the Stereochemistry of Natural Products by Machine Learning" by @MarkusOrsi and Jean-Louis Reymond in ChemRxiv! 👉Read it here: chemrxiv.org/engage/chemrxi… DCBPunibern Reymond Group Universität Bern #naturalproduct #transformer #MachineLearning

It was a nice ending to #EuroQSAR but sad to say goodbye to some friends and colleagues. Karina Martinez Journal of Cheminformatics

Finished my slides for the symposium next week. Journeys in Chemistry Space

First day of the ChEMBL 15th anniversary symposium happing today. It will be dedicated to workshops. We cover data extration & exploration via the web interface, python client, data clean-up, an introduction to the ChEMBL load process & the new SureChEMBL interface & API ChEMBL Database

Call for papers! 13th International Conference on Chemical Structures. Abstract submission has opened! The deadline for the submission of abstracts is the 14th of February 2025. More details, visit iccs-nl.org our linkedin group: lnkd.in/eimzzrRj

Brian Marsden from Oxford University talking about the EUbOPEN project and data deposition to ChEMBL Database

Poster flash talks: first speaker is Preeti Choudhary working at Protein Data Bank . She speaks about the BioChemGraph project. CCDC Cambridge ChEMBL Database

Genevieve Evans' short talk is about fragment screening data Protein Data Bank ChEMBL Database

It has been a busy day. The symposium went really well. So proud of what the ChEMBL Database team has achieved. This is due to contributions of many people in the past & present. Never forget that science is a team effort ❤️

Big news for #DrugDiscovery! 🎉BioChemGraph team released its first dataset, linking 17K+ PDB-ligand complexes to 39K ChEMBL Database bioactivity records in Protein Data Bank & 32K @CCDC IDs in UniChem, speeding drug discovery & repurposing! 🎯 Explore here: ebi.ac.uk/about/news/upd… #OpenData

Want to dive into the BioChemGraph bioactivity dataset for PDB?🚀Here’s a quick guide to access and explore the BCG training material: colab.research.google.com/drive/16wcovcf… #DrugDiscovery #Structuralbiology #OpenData

Excited to speak at the NCATS workshop today: I'll be updating you about ChEMBL Database 's latest developments, some of the challenges related to data curation and annotation & future opportunities.

Our featured GCBR of the week is ChEBI ChEBI, a freely available database and ontology of chemical entities focused on “small” chemical compounds. Click the link to find out more bit.ly/4fDLkkI @EMBL European Commission UK Research and Innovation #globalbiodata #openscience

The ChEMBL-og: Here's a nice Christmas gift - ChEMBL 35 is out! chembl.blogspot.com/2024/12/heres-…

Our featured GCBR of the week is ChEMBL, a manually curated database of bioactive molecules with drug-like properties, bringing together chemical, bioactivity and genomic data. Click the link to find out more bit.ly/3QV4eJ6 UK Research and Innovation Wellcome @EMBL

new: "Fifteen years of ChEMBL and its role in cheminformatics and drug discovery" jcheminf.biomedcentral.com/articles/10.11…

Very proud of the work of the team Open Targets. Dive into our latest Platform release…

Come work with us! This is a new position for a Biological Curator in my team, working closely with other members of the ChEMBL and wider Chemical Biology Services Team.