Computational approaches to define poncirin from Magnolia champaka leaves as a novel multi-target inhibitor of SARS-CoV-2
SM Patil, B Phanindra, PS Shirahatti… - Journal of …, 2023 - Taylor & Francis
Phytochemical-based drug discovery against the severe acute respiratory syndrome
coronavirus-2 (SARS-CoV-2) has been the focus of the current scenario. In this context, we …
coronavirus-2 (SARS-CoV-2) has been the focus of the current scenario. In this context, we …
In silico approach for designing novel SARS-CoV-2 inhibitors from medicinal plants
Medicinal plants belonging to Cameroon flora, could be a source for the discovery of
potential inhibitors of SARS-CoV-2. These two proteins play a pivotal role in mediating viral …
potential inhibitors of SARS-CoV-2. These two proteins play a pivotal role in mediating viral …
Natural phyto, compounds as possible noncovalent inhibitors against SARS-CoV2 protease: computational approach
At present, there is no cure or vaccine for the devastating new highly infectious severe acute
respiratory syndrome coronavirus 2 (SARS-CoV-2) that has affected people globally. Herein …
respiratory syndrome coronavirus 2 (SARS-CoV-2) that has affected people globally. Herein …
Targeting the main protease and the spike protein of SARS-COV-2 with naturally occurring compounds from some cameroonian medicinal plants: an in-silico study for …
RT Fouedjou, HPD Fogang, M Ouassaf… - Journal of the Chilean …, 2022 - SciELO Chile
Despite the social distancing and hygiene rules prescribed by the WHO, the novel Corona-
virus is still on the way of a significant rapid rise in deaths. Therefore, identification of …
virus is still on the way of a significant rapid rise in deaths. Therefore, identification of …
GC-MS profiling of Bauhinia variegata major phytoconstituents with computational identification of potential lead inhibitors of SARS-CoV-2 Mpro
Severe acute respiratory syndrome coronavirus 2 was originally identified in Wuhan city of
China in December 2019 and it spread rapidly throughout the globe, causing a threat to …
China in December 2019 and it spread rapidly throughout the globe, causing a threat to …
Phytochemicals from Leucas zeylanica Targeting Main Protease of SARS-CoV-2: Chemical Profiles, Molecular Docking, and Molecular Dynamics Simulations
M Dutta, AM Tareq, A Rakib, S Mahmud, SA Sami… - Biology, 2021 - mdpi.com
Simple Summary Molecular docking in conjunction with molecular dynamics simulation was
accomplished as they extend an ample opportunity to screen plausible inhibitors of the main …
accomplished as they extend an ample opportunity to screen plausible inhibitors of the main …
Pimenta dioica (L.) Merr. Bioactive Constituents Exert Anti-SARS-CoV-2 and Anti-Inflammatory Activities: Molecular Docking and Dynamics, In Vitro, and In Vivo …
In response to the urgent need to control Coronavirus disease 19 (COVID-19), this study
aims to explore potential anti-SARS-CoV-2 agents from natural sources. Moreover, cytokine …
aims to explore potential anti-SARS-CoV-2 agents from natural sources. Moreover, cytokine …
Computational Investigations for Identification of Bioactive Molecules from Baccaurea ramiflora and Bergenia ciliata as Inhibitors of SARS-CoV-2 Mpro
In this study, a hybrid compound library of 72 phytocompounds from two antiviral medicinal
plants (Baccaurea ramiflora and Bergenia ciliata) was computationally investigated for their …
plants (Baccaurea ramiflora and Bergenia ciliata) was computationally investigated for their …
Structure-based computational screening of 470 natural quercetin derivatives for identification of SARS-CoV-2 Mpro inhibitor
Abstract Coronavirus disease 2019 (COVID-19) is a global pandemic infecting the
respiratory system through a notorious virus known as the severe acute respiratory …
respiratory system through a notorious virus known as the severe acute respiratory …
Bioprospecting phytochemicals of Rosmarinus officinalis L. for targeting SARS-CoV-2 main protease (Mpro): a computational study
Context The persistent spread of highly contagious COVID-19 disease is one of the
deadliest occurrences in the history of mankind. Despite the distribution of numerous …
deadliest occurrences in the history of mankind. Despite the distribution of numerous …
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