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Journal of Biomolecular Structure and Dynamics Volume 40, 2022 - Issue 10
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Research Articles

Computer-based identification of potential compounds from Salviae miltiorrhizae against Neirisaral adhesion A regulatory protein

Md. Oliullah Rafia Department of Genetic Engineering and Biotechnology, Jashore University of Science and Technology, Jashore, BangladeshORCID Iconhttps://orcid.org/0000-0002-1707-655XView further author information
ORCID Icon,
Khattab Al-Khafajib Faculty of Arts and Sciences, Department of Chemistry, Gaziantep University, Gaziantep, TurkeyView further author information
,
Tugba Taskin Tokb Faculty of Arts and Sciences, Department of Chemistry, Gaziantep University, Gaziantep, Turkey;c Institute of Health Sciences, Department of Bioinformatics and Computational Biology, Gaziantep University, Gaziantep, TurkeyORCID Iconhttps://orcid.org/0000-0002-0064-8400View further author information
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Md. Shahedur Rahmana Department of Genetic Engineering and Biotechnology, Jashore University of Science and Technology, Jashore, BangladeshCorrespondence[email protected]
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Pages 4301-4313 | Received 22 May 2020, Accepted 21 Nov 2020, Published online: 08 Dec 2020

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Erkan Oner, Khattab Al-Khafaji, Mezher H. Mezher, Ilter Demirhan, Jaafar Suhail Wadi, Ergul Belge Kurutas, Serap Yalin & Kiattawee Choowongkomon. (2023) Investigation of berberine and its derivatives in Sars Cov-2 main protease structure by molecular docking, PROTOX-II and ADMET methods: in machine learning and in silico study. Journal of Biomolecular Structure and Dynamics 41:19, pages 9366-9381.
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Md. Oliullah Rafi, Khattab Al-Khafaji, Santi M. Mandal, Nigar Sultana Meghla, Polash Kumar Biswas & Md. Shahedur Rahman. (2023) A subunit vaccine against pneumonia: targeting Streptococcus pneumoniae and Klebsiella pneumoniae. Network Modeling Analysis in Health Informatics and Bioinformatics 12:1.
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Ibrahim H. Eissa, Mohamed S. Alesawy, Abdulrahman M. Saleh, Eslam B. Elkaeed, Bshra A. Alsfouk, Abdul-Aziz M. M. El-Attar & Ahmed M. Metwaly. (2022) Ligand and Structure-Based In Silico Determination of the Most Promising SARS-CoV-2 nsp16-nsp10 2′-o-Methyltransferase Complex Inhibitors among 3009 FDA Approved Drugs. Molecules 27:7, pages 2287.
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H. R. Abd El-Mageed, Doaa A. Abdelrheem, Md. Oliullah Rafi, Md. Takim Sarker, Khattab Al-Khafaji, Md. Jamal Hossain, Raffaele Capasso & Talha Bin Emran. (2021) In Silico Evaluation of Different Flavonoids from Medicinal Plants for Their Potency against SARS-CoV-2. Biologics 1:3, pages 416-434.
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Shafi Mahmud, Md. Oliullah Rafi, Gobindo Kumar Paul, Maria Meha Promi, Mst. Sharmin Sultana Shimu, Suvro Biswas, Talha Bin Emran, Kuldeep Dhama, Salem A. Alyami, Mohammad Ali Moni & Md. Abu Saleh. (2021) Designing a multi-epitope vaccine candidate to combat MERS-CoV by employing an immunoinformatics approach. Scientific Reports 11:1.
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