[HTML][HTML] Synthesis, structural characterization, thermal analysis, DFT, biocidal evaluation and molecular docking studies of amide-based Co (II) complexes

Subhash, A Chaudhary, Mamta, Jyoti - Chemical Papers, 2023 - Springer
Many distinct amino acid and aromatic amine-derived transition metal complexes are used
as physiologically active compounds. A few Cobalt (II) complexes have been synthesized by …

[HTML][HTML] Target Prediction of 5, 10, 15, 20-Tetrakis (4′-Sulfonatophenyl)-Porphyrin Using Molecular Docking

AM Udrea, A Dinache, A Staicu, S Avram - Pharmaceutics, 2022 - mdpi.com
Photodynamic therapy has the potential to be a new and effective cancer treatment. Even if
in vitro and in vivo research show promise, the molecular mechanism remains unclear. In …

Photophysical, rotational and translational properties of Radachlorin photosensitizer upon binding to serum albumins

AV Belashov, AA Zhikhoreva, IA Gorbunova… - … et Biophysica Acta (BBA …, 2024 - Elsevier
Introduction Although photophysical properties of Radachlorin photosensitizer (PS) were
extensively studied in solutions and cells, no data is available on variations of its …

Exploring the binding mechanism and adverse toxic effects of chiral phenothrin to human serum albumin: Based on multi-spectroscopy, biochemical and …

Y Gao, C Bian, N Li, K Yao, L Xiao, Z Yang… - Spectrochimica Acta Part …, 2022 - Elsevier
To understand the binding mechanism of a mixture of chiral phenothrin with human serum
albumin (HSA), we used multi-spectroscopy, including steady-state fluorescence …

Mechanism evaluation of the interactions between bisphenol AP and bovine serum albumin based on multi-spectroscopy, wavefunction analysis, and molecular …

G Tian-Zhu, LI Ning, GAO Ya, GAO Ya-Jun… - Chinese Journal of …, 2022 - Elsevier
The hazardous effects of bisphenol compounds on organisms have attracted wide attention.
Hence, elaborating of the specific binding mode of emerging contaminants to …

Interaction mechanisms of the binding of polychlorinated biphenyls to thyroid hormone transporters revealed based on quantum chemistry and spectroscopy

W Miao, D Jia, Y Rui, W Liang, Y Chen, H Liu… - Journal of Molecular …, 2023 - Elsevier
Polychlorinated biphenyls (PCBs) are a kind of persistent, bioaccumulative and refractory
environmental pollutants. In this work, three typical PCBs (CB54, CB125, CB152) were …

Porphyrins Embedded in Translucent Polymeric Substrates: Fluorescence Preservation and Molecular Docking Studies

B González-Santiago, JO Vicente-Escobar… - Journal of …, 2023 - Springer
This research describes the functionalization of polymer-matrix-trapping porphyrins,
considering that the transcendental properties of meso-substituted porphyrins, such as …