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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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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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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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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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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Identification of phytochemical inhibitors against main protease of COVID-19 using molecular modeling approaches
Kumar, Anuj, Choudhir, Gourav, Shukla, Sanjeev Kumar, Sharma, Mansi, Tyagi, Pankaj, Bhushan, Arvind, Rathore, Madhu
Published in Journal of biomolecular structure & dynamics (03.07.2021)
Published in Journal of biomolecular structure & dynamics (03.07.2021)
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Analysis of the interaction behavior between Nano-Curcumin and two human serum proteins: combining spectroscopy and molecular stimulation to understand protein-protein interaction
Mokaberi, Parisa, Babayan-Mashhadi, Fatemeh, Amiri Tehrani Zadeh, Zeinab, Saberi, Mohammad Reza, Chamani, Jamshidkhan
Published in Journal of biomolecular structure & dynamics (13.06.2021)
Published in Journal of biomolecular structure & dynamics (13.06.2021)
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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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Targeting SARS-CoV-2 spike protein of COVID-19 with naturally occurring phytochemicals: an in silico study for drug development
Pandey, Preeti, Rane, Jitendra Subhash, Chatterjee, Aroni, Kumar, Abhijeet, Khan, Rajni, Prakash, Amresh, Ray, Shashikant
Published in Journal of biomolecular structure & dynamics (02.11.2021)
Published in Journal of biomolecular structure & dynamics (02.11.2021)
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Antiviral effects of probiotic metabolites on COVID-19
Anwar, Firoz, Altayb, Hisham N., Al-Abbasi, Fahad A., Al-Malki, Abdulrahman L., Kamal, Mohammad Amjad, Kumar, Vikas
Published in Journal of biomolecular structure & dynamics (24.07.2021)
Published in Journal of biomolecular structure & dynamics (24.07.2021)
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Evaluation of green tea polyphenols as novel corona virus (SARS CoV-2) main protease (Mpro) inhibitors - an in silico docking and molecular dynamics simulation study
Ghosh, Rajesh, Chakraborty, Ayon, Biswas, Ashis, Chowdhuri, Snehasis
Published in Journal of biomolecular structure & dynamics (13.08.2021)
Published in Journal of biomolecular structure & dynamics (13.08.2021)
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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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Reverse vaccinology approach to design a novel multi-epitope vaccine candidate against COVID-19: an in silico study
Enayatkhani, Maryam, Hasaniazad, Mehdi, Faezi, Sobhan, Gouklani, Hamed, Davoodian, Parivash, Ahmadi, Nahid, Einakian, Mohammad Ali, Karmostaji, Afsaneh, Ahmadi, Khadijeh
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 homology assisted identification of inhibitor of RNA binding against 2019-nCoV N-protein (N terminal domain)
Sarma, Phulen, Shekhar, Nishant, Prajapat, Manisha, Avti, Pramod, Kaur, Hardeep, Kumar, Subodh, Singh, Sanjay, Kumar, Harish, Prakash, Ajay, Dhibar, Deba Prasad, Medhi, Bikash
Published in Journal of biomolecular structure & dynamics (01.05.2021)
Published in Journal of biomolecular structure & dynamics (01.05.2021)
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An in-silico evaluation of different Saikosaponins for their potency against SARS-CoV-2 using NSP15 and fusion spike glycoprotein as targets
Sinha, Saurabh K., Shakya, Anshul, Prasad, Satyendra K., Singh, Shashikant, Gurav, Nilambari S., Prasad, Rupali S., Gurav, Shailendra S.
Published in Journal of biomolecular structure & dynamics (13.06.2021)
Published in Journal of biomolecular structure & dynamics (13.06.2021)
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