Virtual screening of Ibuprofen, Celecoxib and Aspirin
收藏NIAID Data Ecosystem2026-03-14 收录
下载链接：
https://doi.org/10.7910/DVN/XMFF8N
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资源简介：
These data are derived from molecular docking of Ibuprofen, Aspirin, celecoxib, and their zinc compounds to both Cox-1 and 2 enzymes. Compounds with better docking scores to Cox 1 and 2 as compared to reference compounds (Ibuprofen, celecoxib, aspirin) were analyzed for toxicity and pharmacokinetic properties. Post docking analysis of compounds was done and results included.
创建时间：
2023-03-18
