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Stochastic voyages into uncharted chemical space produce a representative library of all possible drug-like compounds
The “small molecule universe” (SMU), the set of all synthetically feasible organic molecules of 500 Daltons molecular weight or less, is estimated to contain over 10(60) structures, making exhaustive searches for structures of interest impractical. Here, we describe the construction of a “representa...
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| Asıl Yazarlar: | , , , , |
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| Materyal Türü: | Artigo |
| Dil: | Inglês |
| Baskı/Yayın Bilgisi: |
2013
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| Konular: | |
| Online Erişim: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3670418/ https://ncbi.nlm.nih.gov/pubmed/23548177 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ja401184g |
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