Interest in understanding the photophysics and photochemistry of thiated nucleobases has been awakened because of their possible involvement in primordial RNA or their potential …
In this paper we simulate the deactivation dynamics of photoexcited 6-thioguanine, a cytotoxic analogue of the canonical DNA/RNA base guanine, using a direct surface hopping …
C Reichardt, C Guo… - The Journal of Physical …, 2011 - ACS Publications
Patients treated with the immunosuppressant and anticancer drugs 6-thioguanine, azathioprine, or mercaptopurine can metabolize and incorporate them in DNA as 6 …
LF McGarry, O El-Zubir, PG Waddell, F Cucinotta… - Soft Matter, 2023 - pubs.rsc.org
We describe a simple coordination compound of Au (I) and 6-thioguanosine,[Au (6-tGH) 2] Cl, that has a rich self-assembly chemistry. In aqueous solution, the discrete complex …
The deactivation mechanism of the cytotoxic 6-thioguanine, the 6-sulfur-substituted analogue of the canonical DNA base, is unveiled by ab initio calculations. Oxygen-by-sulfur …
6-Thioguanine, an immunosuppressant and anticancer prodrug, has been shown to induce DNA damage and cell death following exposure to UVA radiation. Its metabolite, 6 …
J Šponer, J Leszczynski, P Hobza - The Journal of Physical …, 1997 - ACS Publications
Base stacking and H-bonding properties of thioguanine and thiouracils were studied using an ab initio quantum chemical method with inclusion of electron correlation (second-order …
FM Siouri, S Boldissar, JA Berenbeim… - The Journal of …, 2017 - ACS Publications
Here we present the excited state dynamics of jet-cooled 6-thioguanine (6-TG), using resonance-enhanced multiphoton ionization (REMPI), IR–UV double resonance …
MJ Stewart, J Leszczynski, YV Rubin… - The Journal of Physical …, 1997 - ACS Publications
High-level ab initio calculations were performed on five of the most stable tautomers of 6- thioguanine (6TG) at the second-and fourth-order levels of correlated Møller− Plesset theory …