Open AccessApplication of the quantum theory of atoms in molecules (QTAIM) to the study of the enzymatic kinetic resolution of propranolol, an amino alcohol with pharmaceutical applications
Author(s) -
David A. Rincón,
Martha C. Daza,
Markus Doerr
Publication year - 2020
Language(s) - English
Resource type - Conference proceedings
DOI - 10.21826/viiiseedmol2020135
Subject(s) - chemistry , atoms in molecules , oxyanion hole , hydrogen bond , catalytic triad , enantiomer , intermolecular force , stereochemistry , molecule , computational chemistry , active site , crystallography , catalysis , organic chemistry