In-silico evaluation of natural alkaloids against the main protease and spike glycoprotein as potential therapeutic agents for SARS-CoV-2

• Mohibullah Shah ,

  Contributed equally to this work with: Mohibullah Shah, Ramsha Yamin

  Roles Conceptualization, Methodology, Project administration, Supervision, Writing – review & editing

  * E-mail: mohib@bzu.edu.pk; mohibusb@gmail.com (MS); chen_ke@swmu.edu.cn (KC)

  Affiliation Department of Biochemistry, Bahauddin Zakariya University, Multan, Pakistan

  https://orcid.org/0000-0001-6126-7102

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• Ramsha Yamin ,

  Contributed equally to this work with: Mohibullah Shah, Ramsha Yamin

  Roles Formal analysis, Investigation, Writing – original draft

  Affiliation Department of Biochemistry, Bahauddin Zakariya University, Multan, Pakistan

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• Iqra Ahmad,

  Roles Formal analysis, Investigation, Writing – original draft

  Affiliation Department of Biochemistry, Bahauddin Zakariya University, Multan, Pakistan

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• Gang Wu,

  Roles Formal analysis, Investigation

  Affiliation Department of Infectious Diseases, The Affiliated Hospital of Southwest Medical University, Luzhou, China

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• Zainab Jahangir,

  Roles Formal analysis, Investigation

  Affiliation Department of Computer Science, University of Agriculture Faisalabad, Punjab, Pakistan

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• Amen Shamim,

  Roles Investigation

  Affiliation Department of Computer Science, University of Agriculture Faisalabad, Punjab, Pakistan

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• Haq Nawaz,

  Roles Data curation, Methodology

  Affiliation Department of Biochemistry, Bahauddin Zakariya University, Multan, Pakistan

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• Umar Nishan,

  Roles Methodology, Software, Writing – review & editing

  Affiliation Department of Chemistry, Kohat University of Science & Technology, Kohat, Pakistan

  https://orcid.org/0000-0002-0106-3068

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• Riaz Ullah,

  Roles Conceptualization, Resources, Writing – review & editing

  Affiliation Department of Pharmacognosy, College of Pharmacy, King Saud University, Riyadh, Saudi Arabia

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• Essam A. Ali,

  Roles Conceptualization, Funding acquisition, Writing – review & editing

  Affiliation Department of Pharmaceutical Chemistry, College of Pharmacy, King Saud University, Riyadh, Saudi Arabia

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• Sheheryar,

  Roles Conceptualization, Investigation, Methodology

  Affiliation Department of Biochemistry and Molecular Biology, Federal University of Ceara, Fortaleza, Brazil

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• Ke Chen

  Roles Conceptualization, Data curation, Funding acquisition, Methodology, Writing – review & editing

  * E-mail: mohib@bzu.edu.pk; mohibusb@gmail.com (MS); chen_ke@swmu.edu.cn (KC)

  Affiliation Department of Infectious Diseases, The Affiliated Hospital of Southwest Medical University, Luzhou, China

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