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Drug repurposing for coronavirus (COVID-19): in silico screening of known drugs against coronavirus 3CL hydrolase and protease enzymes
Elmezayen, Ammar D., Al-Obaidi, Anas, Şahin, Alp Tegin, Yelekçi, Kemal
Published in Journal of biomolecular structure & dynamics (24.05.2021)
Published in Journal of biomolecular structure & dynamics (24.05.2021)
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Molecular docking, validation, dynamics simulations, and pharmacokinetic prediction of natural compounds against the SARS-CoV-2 main-protease
C, Shivanika, S., Deepak Kumar, Ragunathan, Venkataraghavan, Tiwari, Pawan, A., Sumitha, P, Brindha Devi
Published in Journal of biomolecular structure & dynamics (01.02.2022)
Published in Journal of biomolecular structure & dynamics (01.02.2022)
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Computational studies of drug repurposing and synergism of lopinavir, oseltamivir and ritonavir binding with SARS-CoV-2 protease against COVID-19
Muralidharan, Nisha, Sakthivel, R., Velmurugan, D., Gromiha, M. Michael
Published in Journal of biomolecular structure & dynamics (09.04.2021)
Published in Journal of biomolecular structure & dynamics (09.04.2021)
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Oil-in-water nanoemulsions comprising Berberine in olive oil: biological activities, binding mechanisms to human serum albumin or holo-transferrin and QMMD simulations
Sharifi-Rad, Atena, Mehrzad, Jamshid, Darroudi, Majid, Saberi, Mohammad Reza, Chamani, Jamshidkhan
Published in Journal of biomolecular structure & dynamics (11.02.2021)
Published in Journal of biomolecular structure & dynamics (11.02.2021)
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A molecular modeling approach to identify effective antiviral phytochemicals against the main protease of SARS-CoV-2
Islam, Rajib, Parves, Md. Rimon, Paul, Archi Sundar, Uddin, Nizam, Rahman, Md. Sajjadur, Mamun, Abdulla Al, Hossain, Md. Nayeem, Ali, Md. Ackas, Halim, Mohammad A.
Published in Journal of biomolecular structure & dynamics (12.05.2020)
Published in Journal of biomolecular structure & dynamics (12.05.2020)
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A review on the cleavage priming of the spike protein on coronavirus by angiotensin-converting enzyme-2 and furin
Hasan, Anwarul, Paray, Bilal Ahamad, Hussain, Arif, Qadir, Fikry Ali, Attar, Farnoosh, Aziz, Falah Mohammad, Sharifi, Majid, Derakhshankhah, Hossein, Rasti, Behnam, Mehrabi, Masoumeh, Shahpasand, Koorosh, Saboury, Ali Akbar, Falahati, Mojtaba
Published in Journal of biomolecular structure & dynamics (24.05.2021)
Published in Journal of biomolecular structure & dynamics (24.05.2021)
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Using X-ray images and deep learning for automated detection of coronavirus disease
El Asnaoui, Khalid, Chawki, Youness
Published in Journal of biomolecular structure & dynamics (03.07.2021)
Published in Journal of biomolecular structure & dynamics (03.07.2021)
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Discovery of potential multi-target-directed ligands by targeting host-specific SARS-CoV-2 structurally conserved main protease
Joshi, Rakesh S., Jagdale, Shounak S., Bansode, Sneha B., Shankar, S. Shiva, Tellis, Meenakshi B., Pandya, Vaibhav Kumar, Chugh, Anita, Giri, Ashok P., Kulkarni, Mahesh J.
Published in Journal of biomolecular structure & dynamics (13.06.2021)
Published in Journal of biomolecular structure & dynamics (13.06.2021)
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Targeting COVID-19 (SARS-CoV-2) main protease through active phytochemicals of ayurvedic medicinal plants - Withania somnifera (Ashwagandha), Tinospora cordifolia (Giloy) and Ocimum sanctum (Tulsi) - a molecular docking study
Shree, Priya, Mishra, Priyanka, Selvaraj, Chandrabose, Singh, Sanjeev Kumar, Chaube, Radha, Garg, Neha, Tripathi, Yamini Bhusan
Published in Journal of biomolecular structure & dynamics (2022)
Published in Journal of biomolecular structure & dynamics (2022)
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Targeting SARS-CoV-2: a systematic drug repurposing approach to identify promising inhibitors against 3C-like proteinase and 2′-O-ribose methyltransferase
Khan, Rameez Jabeer, Jha, Rajat Kumar, Amera, Gizachew Muluneh, Jain, Monika, Singh, Ekampreet, Pathak, Amita, Singh, Rashmi Prabha, Muthukumaran, Jayaraman, Singh, Amit Kumar
Published in Journal of biomolecular structure & dynamics (24.05.2021)
Published in Journal of biomolecular structure & dynamics (24.05.2021)
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Peptide-like and small-molecule inhibitors against Covid-19
Pant, Suyash, Singh, Meenakshi, Ravichandiran, V., Murty, U. S. N., Srivastava, Hemant Kumar
Published in Journal of biomolecular structure & dynamics (24.05.2021)
Published in Journal of biomolecular structure & dynamics (24.05.2021)
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In-silico approaches to detect inhibitors of the human severe acute respiratory syndrome coronavirus envelope protein ion channel
Gupta, Manoj Kumar, Vemula, Sarojamma, Donde, Ravindra, Gouda, Gayatri, Behera, Lambodar, Vadde, Ramakrishna
Published in Journal of biomolecular structure & dynamics (01.04.2021)
Published in Journal of biomolecular structure & dynamics (01.04.2021)
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Stilbene-based natural compounds as promising drug candidates against COVID-19
Wahedi, Hussain Mustatab, Ahmad, Sajjad, Abbasi, Sumra Wajid
Published in Journal of biomolecular structure & dynamics (13.06.2021)
Published in Journal of biomolecular structure & dynamics (13.06.2021)
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