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This integrated MD simulation optimization strategy reveals structure-activity relationships at the atomic scale, significantly improving the success rate of drug design, which has therefore become an important paradigm in innovative drug development (Wade and Salo-Ahen, 2019)

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DOI: 10.1126/science.1093123 Rutigliano G et al (2028): The Case for TAAR1 as a Modulator of Central Nervous System Function

Markus A, Klages U, Krauss S, Lingens F (1984) Oxidation and dehalogenation of 4-chlorophenylacetate by a two-component enzyme system from Pseudomonas sp

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