Assessment of antiviral potencies of cannabinoids against SARS-CoV-2 using computational and in vitro approaches

V Raj, JG Park, KH Cho, P Choi, T Kim, J Ham… - International journal of …, 2021 - Elsevier
Effective treatment choices to the severe acute respiratory syndrome coronavirus-2 (SARS-
CoV-2) are limited because of the absence of effective target-based therapeutics. The main …

Dehalogenation of persistent halogenated organic compounds: A review of computational studies and quantitative structure–property relationships

J Luo, J Hu, X Wei, L Fu, L Li - Chemosphere, 2015 - Elsevier
Dehalogenation is one of the highly important degradation reactions for halogenated
organic compounds (HOCs) in the environment, which is also being developed as a …

Photocatalytic Degradation of Polychlorinated Dibenzo-p-dioxins on TiO2 Film under UV or Solar Light Irradiation

W Choi, SJ Hong, YS Chang, Y Cho - Environmental science & …, 2000 - ACS Publications
The photocatalytic degradation of polychlorinated dibenzo-p-dioxins (PCDDs), which
include mono-, tetra-, hepta-, and octachlorinated congeners (MCDD, TCDD, HpCDD and …

Rapid Dechlorination of Polychlorinated Dibenzo-p-dioxins by Bimetallic and Nanosized Zerovalent Iron

JH Kim, PG Tratnyek, YS Chang - Environmental science & …, 2008 - ACS Publications
Polychlorinated dibenzo-p-dioxins and furans (PCDD/Fs), especially the 2, 3, 7, 8-
substituted congeners, are extremely toxic, persistent, and recalcitrant to remediation …

[图书][B] Predicting chemical toxicity and fate

MTD Cronin - 2004 - taylorfrancis.com
Quantitative Structure-Activity Relationships (QSARs) are increasingly used to predict the
harmful effects of chemicals to humans and the environment. The increased use of these …

Molecular interactions of ceftazidime with bovine serum albumin: Spectroscopic, molecular docking, and DFT analyses

MS Ali, J Muthukumaran, HA Al-Lohedan - Journal of Molecular Liquids, 2020 - Elsevier
Ceftazidime is a well-known cephalosporin antibiotic included in the World Health
Organization's list of essential medicines. Herein, we investigated the molecular interactions …

Reductive dechlorination of octachlorodibenzo-p-dioxin by nanosized zero-valent zinc: modeling of rate kinetics and congener profile

V Bokare, J Jung, YY Chang, YS Chang - Journal of Hazardous Materials, 2013 - Elsevier
Polychlorinated dibenzo-p-dioxins (PCDDs), a group of recalcitrant toxic compounds, are
ubiquitous in nature. Amongst them, octachlorodibenzo-p-dioxin (OCDD) is not only …

Synthesis, structural characterization and antimicrobial activity of Cu (II) and Fe (III) complexes incorporating azo-azomethine ligand

M Azam, SI Al-Resayes, SM Wabaidur, M Altaf… - Molecules, 2018 - mdpi.com
We are reporting a novel azo-azomethine ligand, HL and its complexes with Cu (II) and Fe
(III) ions. The ligand and its complexes are characterized by various physico-chemical …

Mechanochemical degradation of chlorinated contaminants in fly ash with a calcium-based degradation reagent

Y Mitoma, H Miyata, N Egashira, AM Simion, M Kakeda… - Chemosphere, 2011 - Elsevier
This report presents our results in a low-temperature mechanochemical hydrodechlorination
process applied to fly ash coming from a municipal waste incinerator in order to efficiently …

Experimental and computational investigation on the binding of anticancer drug gemcitabine with bovine serum albumin

MS Ali, J Muthukumaran, M Jain… - Journal of …, 2022 - Taylor & Francis
This study reports the experimental and computational investigation on the binding of a
common anticancer drug, gemcitabine, with the model plasma protein, bovine serum …