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Chemical Space Mimicry for Drug Discovery
We describe a new library generation method, Machine-based Identification of Molecules Inside Characterized Space (MIMICS), that generates sets of molecules inspired by a text-based input. MIMICS-generated libraries were found to preserve distributions of properties while simultaneously increasing s...
Gorde:
| Argitaratua izan da: | J Chem Inf Model |
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| Egile Nagusiak: | , , , , , , , , , , , , |
| Formatua: | Artigo |
| Hizkuntza: | Inglês |
| Argitaratua: |
2017
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| Gaiak: | |
| Sarrera elektronikoa: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5802964/ https://ncbi.nlm.nih.gov/pubmed/28257191 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.6b00754 |
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