Biflavonoids from Rhus succedanea as probable natural inhibitors against SARS-CoV-2: a molecular docking and molecular dynamics approach
K Lokhande, N Nawani… - Journal of …, 2022 - Taylor & Francis
The recent outbreak of SARS-CoV-2 has quickly become a worldwide pandemic and
generated panic threats for both the human population and the global economy. The …
generated panic threats for both the human population and the global economy. The …
Identification of terpenoids as potential inhibitors of SARS-CoV-2 (main protease) and spike (RBD) via computer-aided drug design
H Hadni, A Fitri, A Touimi Benjelloun… - Journal of …, 2023 - Taylor & Francis
The scientific community has been faced with a major challenge in the fight against the
SARS-CoV-2 virus responsible for the COVID-19 pandemic, due to the lack of targeted …
SARS-CoV-2 virus responsible for the COVID-19 pandemic, due to the lack of targeted …
Discovery of Natural Bisbenzylisoquinoline Analogs from the Library of Thai Traditional Plants as SARS-CoV-2 3CLPro Inhibitors: In Silico Molecular Docking, Molecular …
N Khamto, K Utama, S Tateing… - Journal of Chemical …, 2023 - ACS Publications
The emergence of SARS-CoV-2 in December 2019 has become a global issue due to the
continuous upsurge in patients and the lack of drug efficacy for treatment. SARS-CoV-2 …
continuous upsurge in patients and the lack of drug efficacy for treatment. SARS-CoV-2 …
Dietary polyphenols mitigate SARS-CoV-2 main protease (Mpro)–Molecular dynamics, molecular mechanics, and density functional theory investigations
TI Adelusi, AQK Oyedele, OE Monday… - Journal of Molecular …, 2022 - Elsevier
The recent evolution of the SARS-like Coronavirus has ravaged the world. The deadly virus
has claimed over millions of lives across the world and hence highlights the need to develop …
has claimed over millions of lives across the world and hence highlights the need to develop …
[HTML][HTML] A Computational Approach to Elucidate the Interactions of Chemicals From Artemisia annua Targeted Toward SARS-CoV-2 Main Protease Inhibition for …
The inhibitory potential of Artemisia annua, a well-known antimalarial herb, against several
viruses, including the coronavirus, is increasingly gaining recognition. The plant extract has …
viruses, including the coronavirus, is increasingly gaining recognition. The plant extract has …
Inhibitory Activity of Flavonoid Scaffolds on SARS-CoV-2 3CLpro: Insights from the Computational and Experimental Investigations
N Khamto, K Utama, P Boontawee… - Journal of Chemical …, 2024 - ACS Publications
The emergence of the COVID-19 situation has become a global issue due to the lack of
effective antiviral drugs for treatment. Flavonoids are a class of plant secondary metabolites …
effective antiviral drugs for treatment. Flavonoids are a class of plant secondary metabolites …
[HTML][HTML] In Silico Screening of Plant-Derived Anti-virals from Shorea hemsleyana (King) King ex Foxw Against SARS CoV-2 Main Protease
Abstract Shorea hemsleyana (King) King ex Foxw is used to treat various ailments in
humans. Numerous biological activities have been reported previously. The current study …
humans. Numerous biological activities have been reported previously. The current study …
[HTML][HTML] Identification of natural inhibitors against SARS-CoV-2 drugable targets using molecular docking, molecular dynamics simulation, and MM-PBSA approach
PP Kushwaha, AK Singh, T Bansal, A Yadav… - Frontiers in cellular …, 2021 - frontiersin.org
The present study explores the SARS-CoV-2 drugable target inhibition efficacy of
phytochemicals from Indian medicinal plants using molecular docking, molecular dynamics …
phytochemicals from Indian medicinal plants using molecular docking, molecular dynamics …
Metabolites profiling and cheminformatics bioprospection of selected medicinal plants against the main protease and RNA-dependent RNA polymerase of SARS-CoV …
AA Lanrewaju, AM Enitan-Folami… - Journal of …, 2023 - Taylor & Francis
Despite the existence of some vaccines, SARS-CoV-2 (S-2) infections persist for various
reasons relating to vaccine reluctance, rapid mutation rate, and an absence of specific …
reasons relating to vaccine reluctance, rapid mutation rate, and an absence of specific …
Secondary metabolites from spice and herbs as potential multitarget inhibitors of SARS-CoV-2 proteins
Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) has been responsible for
the current global pandemic that has caused a death toll of> 1.12 million worldwide and …
the current global pandemic that has caused a death toll of> 1.12 million worldwide and …