Citations (40)
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Saman Zare Gheshlaghi, Ebrahim Nakhaei, Ali Ebrahimi, Majid Jafari, Asiyeh Shahraki, Shiva Rezazadeh, Erfan Saberinasab, Alireza Nowroozi & Seyede Samira Hosseini. (2023) Analysis of medicinal and therapeutic potential of Withania somnifera derivatives against COVID-19. Journal of Biomolecular Structure and Dynamics 41:14, pages 6883-6893.
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Mejdi Snoussi, Alaeddine Redissi, Amor Mosbah, Vincenzo De Feo, Mohd Adnan, Kaïss Aouadi, Mousa Alreshidi, Mitesh Patel, Adel Kadri & Emira Noumi. (2022) Emetine, a potent alkaloid for the treatment of SARS-CoV-2 targeting papain-like protease and non-structural proteins: pharmacokinetics, molecular docking and dynamic studies. Journal of Biomolecular Structure and Dynamics 40:20, pages 10122-10135.
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Sujit Kumar Debnath, Monalisha Debnath, Rohit Srivastava & Abdelwahab Omri. (2022) Drugs repurposing for SARS-CoV-2: new insight of COVID-19 druggability. Expert Review of Anti-infective Therapy 20:9, pages 1187-1204.
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Mahendera Kumar Meena, Durgesh Kumar, Kamlesh Kumari, Nagendra Kumar Kaushik, Rammapa Venkatesh Kumar, Indra Bahadur, Lata Vodwal & Prashant Singh. (2022) Promising inhibitors of nsp2 of CHIKV using molecular docking and temperature-dependent molecular dynamics simulations. Journal of Biomolecular Structure and Dynamics 40:13, pages 5827-5835.
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Pushyaraga P. Venugopal & Debashree Chakraborty. (2022) Molecular mechanism of inhibition of COVID-19 main protease by β-adrenoceptor agonists and adenosine deaminase inhibitors using in silico methods. Journal of Biomolecular Structure and Dynamics 40:11, pages 5112-5127.
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Mücahit Özdemir, Baybars Köksoy, Deniz Ceyhan, Koray Sayın, Erol Erçağ, Mustafa Bulut & Bahattin Yalçın. (2022) Design and in silico study of the novel coumarin derivatives against SARS-CoV-2 main enzymes. Journal of Biomolecular Structure and Dynamics 40:11, pages 4905-4920.
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Kiran Lokhande, Neelu Nawani, Swamy K. Venkateswara & Sarika Pawar. (2022) Biflavonoids from Rhus succedanea as probable natural inhibitors against SARS-CoV-2: a molecular docking and molecular dynamics approach. Journal of Biomolecular Structure and Dynamics 40:10, pages 4376-4388.
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S. Aishwarya, K. Gunasekaran & A. Anita Margret. (2022) Computational gene expression profiling in the exploration of biomarkers, non-coding functional RNAs and drug perturbagens for COVID-19. Journal of Biomolecular Structure and Dynamics 40:8, pages 3681-3696.
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Ajay Kumar, Durgesh Kumar, Ravinder Kumar, Prashant Singh, Ramesh Chandra & Kamlesh Kumari. (2022) DFT and docking studies of designed conjugates of noscapines & repurposing drugs: promising inhibitors of main protease of SARS-CoV-2 and falcipan-2. Journal of Biomolecular Structure and Dynamics 40:6, pages 2600-2620.
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Yasmine M. Mandour, Darius P. Zlotos & M. Alaraby Salem. (2022) A multi-stage virtual screening of FDA-approved drugs reveals potential inhibitors of SARS-CoV-2 main protease. Journal of Biomolecular Structure and Dynamics 40:5, pages 2327-2338.
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Vipul Kumar, Jaspreet Kaur Dhanjal, Priyanshu Bhargava, Ashish Kaul, Jia Wang, Huayue Zhang, Sunil C. Kaul, Renu Wadhwa & Durai Sundar. (2022) Withanone and Withaferin-A are predicted to interact with transmembrane protease serine 2 (TMPRSS2) and block entry of SARS-CoV-2 into cells. Journal of Biomolecular Structure and Dynamics 40:1, pages 1-13.
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Ashwani Kumar, Kiran Bagri, Manisha Nimbhal & Parvin Kumar. (2021) In silico exploration of the fingerprints triggering modulation of glutaminyl cyclase inhibition for the treatment of Alzheimer’s disease using SMILES based attributes in Monte Carlo optimization. Journal of Biomolecular Structure and Dynamics 39:18, pages 7181-7193.
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Soumita Mukherjee, Subrata Dasgupta, Tapasendra Adhikary, Utpal Adhikari & Sujit Sankar Panja. (2021) Structural insight to hydroxychloroquine-3C-like proteinase complexation from SARS-CoV-2: inhibitor modelling study through molecular docking and MD-simulation study. Journal of Biomolecular Structure and Dynamics 39:18, pages 7322-7334.
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Manish Kumar Tripathi, Pushpendra Singh, Sujata Sharma, Tej P. Singh, A. S. Ethayathulla & Punit Kaur. (2021) Identification of bioactive molecule from Withania somnifera (Ashwagandha) as SARS-CoV-2 main protease inhibitor. Journal of Biomolecular Structure and Dynamics 39:15, pages 5668-5681.
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Pallab Kar, Neeta Raj Sharma, Bhupender Singh, Arnab Sen & Ayan Roy. (2021) Natural compounds from Clerodendrum spp. as possible therapeutic candidates against SARS-CoV-2: An in silico investigation. Journal of Biomolecular Structure and Dynamics 39:13, pages 4774-4785.
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Mohammad Reza Khazdair, Shoukouh Ghafari & Mahmood Sadeghi. (2021) Possible therapeutic effects of Nigella sativa and its thymoquinone on COVID-19. Pharmaceutical Biology 59:1, pages 694-701.
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Toni C. Denner, Niels Heise, Julian Zacharias, Oliver Kraft, Sophie Hoenke & René Csuk. (2023) Small Structural Differences Govern the Carbonic Anhydrase II Inhibition Activity of Cytotoxic Triterpene Acetazolamide Conjugates. Molecules 28:3, pages 1009.
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Shiv Kumar Prajapati, Akanksha Malaiya, Gaurav Mishra, Dolly Jain, Payal Kesharwani, Nishi Mody, Amirhossein Ahmadi, Rishi Paliwal & Ankit Jain. (2022) An exhaustive comprehension of the role of herbal medicines in Pre- and Post-COVID manifestations. Journal of Ethnopharmacology 296, pages 115420.
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Varinder Singh, Kiranpreet Kaur, Sanimardeep Kaur, Richa Shri, Thakur Gurjeet Singh & Manjinder Singh. (2022) Trimethoxyflavones from Ocimum basilicum L. leaves improve long term memory in mice by modulating multiple pathways. Journal of Ethnopharmacology 295, pages 115438.
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Anees Ahmed Mahaboob Ali, Andrea Bugarcic, Nenad Naumovski & Reena Ghildyal. (2022) Ayurvedic formulations: Potential COVID-19 therapeutics?. Phytomedicine Plus 2:3, pages 100286.
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Juhi Saraswat, Ufana Riaz & Rajan Patel. (2022) In-silico study for the screening and preparation of ionic liquid-AVDs conjugate to combat COVID-19 surge. Journal of Molecular Liquids 359, pages 119277.
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Sumit Kumar Mandal, Banoth Karan Kumar, Pankaj Kumar Sharma, Sankaranarayanan Murugesan & P.R. Deepa. (2022) In silico and in vitro analysis of PPAR – α / γ dual agonists: Comparative evaluation of potential phytochemicals with anti-obesity drug orlistat. Computers in Biology and Medicine 147, pages 105796.
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B. Uma Reddy, Nanda Kishore Routhu & Anuj Kumar. (2022) Multifaceted roles of plant derived small molecule inhibitors on replication cycle of SARS-CoV-2. Microbial Pathogenesis 168, pages 105512.
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Ajay Yadav, Monu Dinesh Ojha & P. Hariprasad. (2022) Computational studies evidenced the potential of steroidal lactone to disrupt surface interaction of SARS-CoV-2 spike protein and hACE2. Computers in Biology and Medicine 146, pages 105598.
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Dr. Sameer Jamadagni, Dr. Prasad Pandkar, Dr. Tushar Saundankar, Dr. Girish Shirke, Shailesh Malekar & Dr.VG. Vaidya. (2022) Efficacy of Madhav Rasayan Plus as adjuvant in moderate COVID-19 patients: Preliminary Outcomes of Randomized controlled trial. Journal of Ayurveda and Integrative Medicine, pages 100590.
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Gholamhossein Sodeifian, Ratna Surya Alwi & Fariba Razmimanesh. (2022) Solubility of Pholcodine (antitussive drug) in supercritical carbon dioxide: Experimental data and thermodynamic modeling. Fluid Phase Equilibria 556, pages 113396.
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Gui-yang Xia, Shi-jie Cao, Li-xia Chen & Feng Qiu. (2022) Natural withanolides, an update. Natural Product Reports 39:4, pages 784-813.
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Prasanta Kumar Sarkar & Chitrangada Das Mukhopadhyay. (2022) Mechanistic insights from the review and evaluation of ayurvedic herbal medicines for the prevention and management of COVID-19 patients. Journal of Herbal Medicine 32, pages 100554.
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Parastou Farshi, Eda Ceren Kaya, Fataneh Hashempour-Baltork & Kianoush Khosravi-Drani. (2022) The Effect of Plant Metabolites on Coronaviruses: A Comprehensive
Review Focusing on their IC50 Values and Molecular Docking Scores. Mini-Reviews in Medicinal Chemistry 22:3, pages 457-483.
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Felix Zulhendri, Conrad O. Perera, Steven Tandean, Rizky Abdulah, Herry Herman, Andreas Christoper, Kavita Chandrasekaran, Arfiza Putra & Ronny Lesmana. (2022) The Potential Use of Propolis as a Primary or an Adjunctive Therapy in Respiratory Tract-Related Diseases and Disorders: A Systematic Scoping Review. Biomedicine & Pharmacotherapy 146, pages 112595.
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R. S. Remya, N. Ramalakshmi, C.N. Nalini, V. Niraimathi & S. Amuthalakshmi. (2022) Design Synthesis and in vitro Evaluation of Tacrine-flavone Hybrids as
Multifunctional Cholinesterase Inhibitors for Alzheimer’s Disease. Current Computer-Aided Drug Design 18:4, pages 271-292.
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Minjun Lee, Junwoo Park & Ik-Hyun Cho. (2022) Target-Specific Drug Discovery of Natural Products against SARS-CoV-2 Life Cycle and Cytokine Storm in COVID-19. The American Journal of Chinese Medicine 50:04, pages 927-959.
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Sevgi Kolayli. 2022. Bee Products and Their Applications in the Food and Pharmaceutical Industries. Bee Products and Their Applications in the Food and Pharmaceutical Industries
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Fiona C. Rodrigues, Gangadhar Hari, K. S. R. Pai, Akhil Suresh, Usha Y. Nayak, N. V. Anilkumar & Goutam Thakur. (2021) Molecular modeling piloted analysis for semicarbazone derivative of curcumin as a potent Abl-kinase inhibitor targeting colon cancer. 3 Biotech 11:12.
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Jignesh Prajapati, Rohit Patel, Dweipayan Goswami, Meenu Saraf & Rakesh M. Rawal. (2021) Sterenin M as a potential inhibitor of SARS-CoV-2 main protease identified from MeFSAT database using molecular docking, molecular dynamics simulation and binding free energy calculation. Computers in Biology and Medicine 135, pages 104568.
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Salvatore Vincenzo Giofrè, Edoardo Napoli, Nunzio Iraci, Antonio Speciale, Francesco Cimino, Claudia Muscarà, Maria Sofia Molonia, Giuseppe Ruberto & Antonella Saija. (2021) Interaction of selected terpenoids with two SARS-CoV-2 key therapeutic targets: An in silico study through molecular docking and dynamics simulations. Computers in Biology and Medicine 134, pages 104538.
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Maoyuan Jiang, Feiya Sheng, Zhen Zhang, Xiao Ma, Tianhui Gao, Chaomei Fu & Peng Li. (2021) Andrographis paniculata (Burm.f.) Nees and its major constituent andrographolide as potential antiviral agents. Journal of Ethnopharmacology 272, pages 113954.
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Shahrukh Qureshi, Ravina Khandelwal, Maddala Madhavi, Naveesha Khurana, Neha Gupta, Saurav K. Choudhary, Revathy A. Suresh, Lima Hazarika, Chillamcherla D. Srija, Khushboo Sharma, Mali R. Hindala, Tajamul Hussain, Anuraj Nayarisseri & Sanjeev K. Singh. (2021) A Multi-target Drug Designing for BTK, MMP9, Proteasome and TAK1 for the Clinical Treatment of Mantle Cell Lymphoma. Current Topics in Medicinal Chemistry 21:9, pages 790-818.
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Sanjay Kumar Mishra & Timir Tripathi. (2021) One year update on the COVID-19 pandemic: Where are we now?. Acta Tropica 214, pages 105778.
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Ana C. Fiorini, Carla A. Scorza, Antonio-Carlos G. de Almeida, Marcelo C.M. Fonseca, Josef Finsterer, Fernando L.A. Fonseca & Fulvio A. Scorza. (2021) Antiviral activity of Brazilian Green Propolis extract against SARS-CoV-2 (Severe Acute Respiratory Syndrome - Coronavirus 2) infection: case report and review. Clinics 76, pages e2357.
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