Assessing Configurational Sampling in the Quantum Mechanics/Molecular Mechanics Calculation of Temoporfin Absorption Spectrum and Triplet Density of States

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Authors: Martina De Vetta, Omar Baig, Dorika Steen, Juan Nogueira, Leticia González

Journal title: Molecules

Journal number: 23/11

Journal publisher: Multidisciplinary Digital Publishing Institute (MDPI)

Published year: 2018

Published pages: 2932

DOI identifier: 10.3390/molecules23112932

ISSN: 1420-3049