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Steigerung der Interkombinationseffizienz in Phenothiazinfarbstoffen durch Einlagerung in DNA.
- Published in:
- Angewandte Chemie, 2015, v. 127, n. 14, p. 4450, doi. 10.1002/ange.201411456
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- Article
"On-The-Fly" Non-Adiabatic Dynamics Simulations on Photoinduced Ring-Closing Reaction of a Nucleoside-Based Diarylethene Photoswitch.
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- Molecules, 2021, v. 26, n. 9, p. 2724, doi. 10.3390/molecules26092724
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- Article
Solution and Solid-State Photophysical Properties of Positional Isomeric Acrylonitrile Derivatives with Core Pyridine and Phenyl Moieties: Experimental and DFT Studies.
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- Molecules, 2021, v. 26, n. 6, p. 1500, doi. 10.3390/molecules26061500
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- Article
Stacking Effects on Anthraquinone/DNA Charge-Transfer Electronically Excited States.
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- Molecules, 2020, v. 25, n. 24, p. 5927, doi. 10.3390/molecules25245927
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- Article
Assessing Configurational Sampling in the Quantum Mechanics/Molecular Mechanics Calculation of Temoporfin Absorption Spectrum and Triplet Density of States.
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- Molecules, 2018, v. 23, n. 11, p. 2932, doi. 10.3390/molecules23112932
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- Article
Challenges in Simulating Light-Induced Processes in DNA.
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- Molecules, 2017, v. 22, n. 1, p. 49, doi. 10.3390/molecules22010049
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- Article
Hydrogen Bonding Regulates the Rigidity of Liposome‐Encapsulated Chlorin Photosensitizers.
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- ChemistryOpen, 2018, v. 7, n. 6, p. 475, doi. 10.1002/open.201800050
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- Article
MoBioTools: A toolkit to setup quantum mechanics/molecular mechanics calculations.
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- Journal of Computational Chemistry, 2023, v. 44, n. 4, p. 516, doi. 10.1002/jcc.27018
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- Article
The Permeation Mechanism of Cisplatin Through a Dioleoylphosphocholine Bilayer**.
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- ChemPhysChem, 2021, v. 22, n. 12, p. 1251, doi. 10.1002/cphc.202100059
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- Article
Biological evaluation of novel thiomaltol-based organometallic complexes as topoisomerase IIα inhibitors.
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- Journal of Biological Inorganic Chemistry (JBIC), 2020, v. 25, n. 3, p. 451, doi. 10.1007/s00775-020-01775-2
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- Article
Enhancing Intersystem Crossing in Phenotiazinium Dyes by Intercalation into DNA.
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- Angewandte Chemie International Edition, 2015, v. 54, n. 14, p. 4375, doi. 10.1002/anie.201411456
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- Article
An algorithm to correct for the CASSCF active space in multiscale QM/MM calculations based on geometry ensembles.
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- International Journal of Quantum Chemistry, 2021, v. 121, n. 6, p. 1, doi. 10.1002/qua.26533
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- Article
On the Permeation of Polychlorinated Dibenzodioxins and Dibenzofurans through Lipid Membranes: Classical MD and Hybrid QM/MM-EDA Analysis.
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- Membranes, 2023, v. 13, n. 1, p. 28, doi. 10.3390/membranes13010028
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- Article
Mechanism of Ultrafast Intersystem Crossing in 2‐Nitronaphthalene.
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- Chemistry - A European Journal, 2018, v. 24, n. 20, p. 5379, doi. 10.1002/chem.201705854
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- Article
Automatic characterization of drug/amino acid interactions by energy decomposition analysis.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2023, v. 142, n. 6, p. 1, doi. 10.1007/s00214-023-02997-8
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- Article