Computational design of an amidase by combining the best electrostatic features of two promiscuous hydrolases
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DOI: 10.1039/d2sc00778a
Abstract: While there has been emerging interest in designing new enzymes to solve practical challenges, computer-based options to redesign catalytically active proteins are rather limited. Here, a rational QM/MM molecular dynamics strategy based on combining the… read more here.
Keywords: amidase; best electrostatic; computational design; combining best ... See more keywords