โ๏ธCloud & DevOps
I built a DuckDB extension to handle chemistry data without pandas or RDKit
Idea While reproducing top solutions of a chemistry data competition, I started building a DuckDB community extension for handling chemistry data directly in SQL. Parse SMILES, InChI, PDB and other chemistry formats directly โ no pandas, no RDKit on the side Plug into DuckDB's native CSV/Parquet/Ice
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