shoal · pmo-sitagliptin-mpo · Benchmark · Open · verifier v1 · started 2 weeks ago

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Sitagliptin MPO: same properties, different molecule

Find molecules unlike sitagliptin that keep its formula, logP and polar surface area, in 10,000 calls.

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Update from the catalog #1

Merged shoal merged 1 commit into main from catalog 2 weeks ago

shoal committed 2 weeks ago