[HTML][HTML] Potential herb–drug interactions between anti-COVID-19 drugs and traditional Chinese medicine
L Ye, S Fan, P Zhao, C Wu, M Liu, S Hu, P Wang… - … Pharmaceutica Sinica B, 2023 - Elsevier
Abstract Coronavirus disease 2019 (COVID-19), caused by severe acute respiratory
syndrome coronavirus 2 (SARS-CoV-2), has spread worldwide. Effective treatments against …
syndrome coronavirus 2 (SARS-CoV-2), has spread worldwide. Effective treatments against …
Computational study of non-linear optical and electrical properties of 1, 3-dinitropyrene
This study aims to explore the optoelectronic properties of a pyrene derivative 1, 3-
dinitropyrene using density functional theory to determine molecular electrostatic potential …
dinitropyrene using density functional theory to determine molecular electrostatic potential …
Alkaloids from Piper longum Exhibit Anti-inflammatory Activity and Synergistic Effects with Chemotherapeutic Agents against Cervical Cancer Cells
Q Wan, J Xu, C Zhu, X Liu, Y Tu, J Lei… - Journal of Agricultural …, 2023 - ACS Publications
Piper longum L. is widely cultivated for food, medicine, and other purposes in tropical and
subtropical regions. Sixteen compounds including nine new amide alkaloids were isolated …
subtropical regions. Sixteen compounds including nine new amide alkaloids were isolated …
Influence of Adsorption of Gold and Silver Nanoclusters on Structural, Electronic, and Nonlinear optical properties of Pentacene-5, 12-dione: A DFT study
The present study deals with the investigation of the change in the hyperpolarizability of
Pentacene-2, 5-dione (PD) on the introduction of the gold (Au) and silver (Ag) nanoclusters …
Pentacene-2, 5-dione (PD) on the introduction of the gold (Au) and silver (Ag) nanoclusters …
Study of nonlinear optical responses of phytochemicals of Clitoria ternatea by quantum mechanical approach and investigation of their anti-Alzheimer activity with in …
Clitoria ternatea is a flowering plant with promising medicinal plants with a wide variety of
active phytochemicals. The present study aimed at the computational investigation of the …
active phytochemicals. The present study aimed at the computational investigation of the …
Photovoltaic characteristics of organic heterocyclic 2, 9-dimethyl quinacridone in different solvents using DFT approach
In this work, efforts had been made to develop the photovoltaic utility of 2, 9-dimethyl
quinacridone (2, 9-DMQA) using density functional theory (DFT). Initially, the structural …
quinacridone (2, 9-DMQA) using density functional theory (DFT). Initially, the structural …
A comprehensive exploration of pharmacological properties, bioactivities and inhibitory potentiality of luteolin from Tridax procumbens as anticancer drug by in-silico …
Tridax procumbens is a flowering plant of the Asteraceae family with a wide range of
medicinal uses like anti-inflammatory, anti-diabetic, anti-microbial, immunomodulatory, etc …
medicinal uses like anti-inflammatory, anti-diabetic, anti-microbial, immunomodulatory, etc …
Theoretical study on spectral and optical properties of essential amino acids: a comparative study
In the present work, a theoretical study has been performed targeting essential amino acids
(EAA) Histidine, Isoleucine, Leucine, Lysine, Methionine, Phenylalanine, Threonine …
(EAA) Histidine, Isoleucine, Leucine, Lysine, Methionine, Phenylalanine, Threonine …
Modelling the DFT structural and reactivity study of feverfew and evaluation of its potential antiviral activity against COVID-19 using molecular docking and MD …
The unavailability of a proper drug against SARS-CoV-2 infections and the emergence of
various variants created a global crisis. In the present work, we have studied the antiviral …
various variants created a global crisis. In the present work, we have studied the antiviral …
Discover the Medication Potential of Algerian Medicinal Plants Against Sars-Cov-2 Main Protease (Mpro): Molecular Docking, Molecular Dynamic Simulation, and …
At the end of 2019, the world faced a big challenge and crisis caused by the SARS-CoV-2
virus. It spreads rapidly and is contagious; no treatment has officially been found. Algeria …
virus. It spreads rapidly and is contagious; no treatment has officially been found. Algeria …