AIMC Topic: Metabolic Detoxication, Phase I
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Predicting routes of phase I and II metabolism based on quantum mechanics and machine learning.
Xenobiotica; the fate of foreign compounds in biological systems
Aug 21, 2024
Unexpected metabolism could lead to the failure of many late-stage drug candidates or even the withdrawal of approved drugs. Thus, it is critical to predict and study the dominant routes of metabolism in the early stages of research.We describe the d...
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