Phytochemical Profiling, Biological Activities, and In Silico Molecular Docking Studies of Causonis trifolia (L.) Mabb. & J.Wen Shoot

S Hazra, AS Ray, S Das, A Das Gupta, CH Rahaman - Plants, 2023 - mdpi.com
Causonis trifolia (L.) Mabb. & J. Wen, commonly known as “fox grape”, is an
ethnomedicinally important twining herb of the Vitaceae family, and it is used by ethnic …

Steroidal lactones from Withania somnifera effectively target Beta, Gamma, Delta and Omicron variants of SARS-CoV-2 and reveal a decreased susceptibility to viral …

A Srivastava, R Ahmad, IA Wani, S Siddiqui… - In Silico …, 2024 - Springer
Prevention from disease is presently the cornerstone of the fight against COVID-19. With the
rapid emergence of novel SARS-CoV-2 variants, there is an urgent need for novel or …

Further investigation of harmicines as novel antiplasmodial agents: Synthesis, structure-activity relationship and insight into the mechanism of action

M Marinović, G Poje, I Perković, D Fontinha… - European journal of …, 2021 - Elsevier
The rise of the resistance of the malaria parasite to the currently approved therapy urges the
discovery and development of new efficient agents. Previously we have demonstrated that …

Phloroglucinol as a Potential Candidate against Trypanosoma congolense Infection: Insights from In Vivo, In Vitro, Molecular Docking and Molecular Dynamic …

NI Abdulrashid, S Aminu, RM Adamu, N Tajuddeen… - Molecules, 2022 - mdpi.com
Sub-Saharan Africa is profoundly challenged with African Animal Trypanosomiasis and the
available trypanocides are faced with drawbacks, necessitating the search for novel agents …

Network pharmacology-integrated molecular docking analysis of phytocompounds of Caesalpinia pulcherrima (peacock flower) as potential anti-metastatic agents

T Hao Dong, A Yau Wen Ning… - Journal of Biomolecular …, 2024 - Taylor & Francis
Caesalpinia pulcherrima, or peacock flower, has been a subject of cancer therapeutics
research, showing promising anti-cancer and anti-metastatic properties. The present …

Repurposing phytochemicals of Citrullus colocynthis against maltase-glucoamylase using molecular docking, MMGBSA, MD simulation and linear regression to …

P Sahu, R Sahoo, AK Sahu, SS Saluja… - Journal of Biomolecular …, 2024 - Taylor & Francis
Diabetes is a common lifestyle disorder found in populations of different age groups.
Maltase-glucoamylase catalyses the release of the glucose molecule in the final enzymatic …

Therapeutic potential of dietary phytochemicals from Drynaria quercifolia to modulate gut microbiome: an in silico approach

ML Ragavan, H Srinivasan - Journal of Biomolecular Structure and …, 2023 - Taylor & Francis
Drynaria quercifolia is one of the pioneer medicinal plants which exert many beneficial
effects on humans. Fatty acids are hydrophobic ligands that act as membrane substrates …

Exploration of In Vivo and In Vitro Biological Effects of Sonneratia caseolaris (L.) Fruits Supported by Molecular Docking and ADMET Study

P Kundu, SL Debnath, MF Ahad… - BioMed Research …, 2023 - Wiley Online Library
Sonneratia caseolaris (L.) is a common mangrove plant which has significant medicinal
value in traditional medicine. Ethanol extract from the fruits of S. caseolaris (SCE) was used …

ADMET profile and virtual screening of plant and microbial natural metabolites as SARS-CoV-2 S1 glycoprotein receptor binding domain and main protease inhibitors

S Padhi, M Masi, R Chourasia, Y Rajashekar… - European journal of …, 2021 - Elsevier
In an attempt to search for selective inhibitors against the SARS-CoV-2 which caused
devastating of lives and livelihoods across the globe, 415 natural metabolites isolated from …

[HTML][HTML] Flavonoids of Zinnia elegans: Chemical profile and in vitro antioxidant and in silico anti-COVID-19 activities

MN Samy, AAR Gomaa, EZ Attia, MAA Ibrahim… - South African Journal of …, 2022 - Elsevier
Chemical profiles of total alcohol extract and various derived fractions of aerial parts of
Zinnia elegans were studied. Accordingly, eight flavonoids were isolated from the ethyl …