Concepts, Challenges, and Successes in Modeling Thermodynamics of Metabolism

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Concepts, Challenges, and Successes in Modeling Thermodynamics of Metabolism

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ژورنال

عنوان ژورنال: Frontiers in Bioengineering and Biotechnology

سال: 2014

ISSN: 2296-4185

DOI: 10.3389/fbioe.2014.00053