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Published in 2022 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.26957
Abstract: Flavins are employed as redox cofactors and chromophores in a plethora of flavoenzymes. Their versatility is an outcome of intrinsic molecular properties of the isoalloxazine ring modulated by the protein scaffold and surrounding solvent. Thus,…
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Keywords:
tautomeric equilibria;
molecular properties;
chemistry;
isolated flavins ... See more keywords