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physics.chem-ph2026
Efficient Calculation of Absorption Spectra of Platinum Complexes Used as Luminescent Probes for Cancer Detection
Lena T. T. Nguyen, Ernst D. Larsson, Kajsa M. F. Niklasson +2
Despite major advances in oncology, many chemotherapeutic agents still cause severe side effects that reduce quality of life, motivating new approaches for early detection and targ…
physics.chem-ph2019
Is density functional theory accurate for lytic polysaccharide monooxygenase enzymes?
Ernst D. Larsson, Geng Dong, Valera Veryazov +2
The lytic polysaccharide monooxygenase (LPMO) enzymes boost polysaccharide depolymerization through oxidative chemistry, which has fueled the hope for more energy-efficient product…