The activity coefficients of the most active compounds in ChEBI when compared to the active compounds in each set.
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https://figshare.com/articles/dataset/_The_activity_coefficients_of_the_most_active_compounds_in_ChEBI_when_compared_to_the_active_compounds_in_each_set_/498072
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资源简介：
For each compound, a reference showing that the compound is indeed active is given. The thresholds for each problem, as determined by the algorithm detailed in the Methodology section, are 0.243 (BBB), 0.272 (P-gp) and 0.231 (estrogen).
创建时间：
2010-09-23
