IRENE >> Partners >>MSU

Belozersky Institute of Physicochemical Biology

Molecular modeling methodology for in silico evaluation of enzyme substrate specificity, enantioselectivity, synthetic efficiency in biocatalytic acyl transfer reactions; molecular modeling of enzymes using molecular dynamics, molecular docking, hybrid QM\MM methods; bioinformatic analysis of evolutionary relationships, search for specificity and enantioselectivity determining positions; experimental production and kinetic studies of mutants.
Member of the PSC and DIPC. Russian coordinator
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