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ZINC – A Free Database of Commercially Available Compounds for Virtual Screening
A critical barrier to entry into structure-based virtual screening is the lack of a suitable, easy to access database of purchasable compounds. We have therefore prepared a library of 727 842 molecules, each with 3D structure, using catalogs of compounds from vendors (the size of this library contin...
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| Asıl Yazarlar: | , |
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| Materyal Türü: | Artigo |
| Dil: | Inglês |
| Baskı/Yayın Bilgisi: |
2005
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| Konular: | |
| Online Erişim: | https://ncbi.nlm.nih.gov/pmc/articles/PMC1360656/ https://ncbi.nlm.nih.gov/pubmed/15667143 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci049714 |
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