doi: 10.1021/ci9601123.
META. 3. A genetic algorithm for metabolic transform priorities optimization
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- PMID: 9157102
- DOI: 10.1021/ci9601123
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META. 3. A genetic algorithm for metabolic transform priorities optimization
J Chem Inf Comput Sci.
1997 Mar-Apr.
Abstract
META is a knowledge-based expert system that simulates the biotransformation of xenobiotics. It operates with the help of a dictionary (knowledge base) to seek target fragments in a compound and transform them to products. Here, a genetic algorithm is introduced to help build the knowledge base and optimize the performance of the methodology.
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