Journal of biomolecular structure & dynamics

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Journal of biomolecular structure & dynamics

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Results 1-6 of 6 (Search time: 0.0 seconds).

Issue DateTitleAuthor(s)
1Feb-2023Analysis and prediction pathways of natural products and their cytotoxicity against HeLa cell line protein using docking, molecular dynamics and ADMETAl-Jumaili, Mohammed Hadi Ali; Siddique, Farhan; Abul Qais, Faizan; Hashem, Heba ; Chtita, Samir; Rani, Abida; Uzair, Muhammad; Almzaien, Kahtan A
230-Jan-2024Chemical exploration of different extracts from Phytolacca americana leaves and their potential utilization for global health problems: ın silico and network pharmacology validationFahmy, Nouran M; Fayez, Shaimaa; Zengin, Gokhan; Selvi, Selami; Uba, Abdullahi Ibrahim; Mollica, Adriano; Bouyahya, Abdelhakim; Ponniya, Sathish Kumar M; Nilofar, null; Lekmine, Sabrina; Ferrante, Claudio; Eldahshan, Omayma 
32024A computational investigation of galactopyranoside esters as antimicrobial agents through antiviral, molecular docking, molecular dynamics, pharmacokinetics, and bioactivity predictionHosen, Mohammed A; El Bakri, Youness; Rehman, Hafiz Muzzammel; Hashem, Heba ; Saki, Morteza; Kawsar, Sarkar M A
420-Dec-2021Design, synthesis, biomedical investigation, DFT calculation and molecular docking of novel Ru(II)-mixed ligand complexesMohamed, Sara E; Ramadan, Ramadan M. ; Aboelhasan, Amir E; Abdel Aziz, Ayman A
52023Design, synthesis, spectroscopic characterization, in-vitro antibacterial evaluation and in-silico analysis of polycaprolactone containing chitosan-quercetin microspheresAzeem, Muhammad; Hanif, Muhammad; Mahmood, Khalid; Siddique, Farhan; Hashem, Heba ; Aziz, Mubashir; Ameer, Nabeela; Abid, Usman; Latif, Hafsa; Ramzan, Nasreen; Rawat, Ravi
61-Jan-2022Synthesis, antimicrobial activities, docking studies and computational calculations of new bis-1,4-phenylene -1H-1,2,3-triazole derivatives utilized ultrasonic energySoror, Sahar; Fahim, Asmaa M.; Elabbady, Samia; Nassar, Ekhlass; Aboelnaga, Asmaa