Transferability of the Electrostatic Parameters of the Polarizable Gaussian Multipole Model

S Zhao, P Cieplak, Y Duan, R Luo - Journal of chemical theory …, 2023 - ACS Publications
Accuracy and transferability are the two highly desirable properties of molecular mechanical
force fields. Compared with the extensively used point-charge additive force fields that apply …

Photoinduced water–chromophore electron transfer causes formation of guanosine photodamage

MJ Janicki, R Szabla, J Šponer… - Physical Chemistry …, 2022 - pubs.rsc.org
UV-induced photolysis of aqueous guanine nucleosides produces 8-oxo-guanine and Fapy-
guanine, which can induce various types of cellular malfunction. The mechanistic rationale …