Physical chemistry chemical physics : PCCPMachine LearningSinglet OxygenFluoroquinolonesQuantum TheoryPteridines
Predicting the quantum yield of 1O2 generation for pteridines and fluoroquinolones using machine learning.
Platon P Chebotaev, Andrey A Buglak
Published: 202510.1039/d5cp02333e
Abstract
Fluoroquinolones (FQs) are a family of antibiotic drugs well-known for their high photochemical activity: upon UV-vis excitation FQs may produce singlet oxygen and/or lose the fluorine atom. Pterins (Ptrs) are a class of organic photosensitizers with…
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