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Library ranks assigned to FDA-approved drugs in virtual screening for HIV-1 protease inhibitors.

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https://figshare.com/articles/dataset/_Library_ranks_assigned_to_FDA_approved_drugs_in_virtual_screening_for____HIV_1_protease_inhibitors_/567821
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资源简介:
*From: http://www.fda.gov/oashi/aids/virals.html. †CAS Registry at http://www.cas.org/. ‡Maximal Tanimoto coefficient to template-bound ligands (<35% target -template sequence identity). §Ranks assigned by FINDSITE, FINDSITELHM and these resulted from data fusion (FINDSITE/FINDSITELHM); the screening library consists of 124,363 compounds; ranks in bold and italics are within the top 5% and 1% of the library, respectively.
创建时间:
2009-06-05
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