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Toxicity
The dataset includes 171 molecules designed for functional domains of a core clock protein, CRY1, responsible for generating circadian rhythm. 56 of the molecules are toxic and the rest are non-toxic.
Period Changer
The dataset includes 90 non-toxic molecules designed for functional domain of a core clock protein, CRY1, of which 27 molecules significantly lengthen the period of circadian rhythm and the rest, 63 molecules, are no changers.
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