Fragment molecular orbital (FMO) method for studying actinide-protein interaction
Fragment molecular orbital (FMO) method for studying actinide-protein interaction
Abstract
In this talk, I will present progress in the research on the use of fragment molecular orbital calculations to the system containing lanthanide and actinide.
-
Eingeladener Vortrag (Konferenzbeitrag)
Theory Frontiers in Actinide Science: Chemistry and Materials, 26.02.-01.03.2023, Santa Fe, USA
Permalink: https://www.hzdr.de/publications/Publ-36597