Physicochemical, spectral, medicinal, and toxicological studies of Ketoprofen, Ibuprofen, and their major degradants: A quantum-chemical and in silico approach

• Protyoi Chakraborty ,

  Contributed equally to this work with: Protyoi Chakraborty, Saithajit Mohajan, Mahbub Alam, Monir Uzzaman

  Roles Formal analysis, Investigation, Visualization, Writing – original draft

  Affiliations Department of Chemistry, School of Physical Sciences, Shahjalal University of Science and Technology, Sylhet, Bangladesh, Department of Drug Design, Computer in Chemistry and Medicine Laboratory, Dhaka, Bangladesh

  https://orcid.org/0009-0001-0338-2636

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• Saithajit Mohajan ,

  Contributed equally to this work with: Protyoi Chakraborty, Saithajit Mohajan, Mahbub Alam, Monir Uzzaman

  Roles Formal analysis, Methodology, Visualization, Writing – original draft

  Affiliations Department of Drug Design, Computer in Chemistry and Medicine Laboratory, Dhaka, Bangladesh, Department of Applied Chemistry and Chemical Engineering, University of Chittagong, Chattogram, Bangladesh

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• Omme Samia,

  Roles Formal analysis, Investigation, Writing – original draft

  Affiliations Department of Drug Design, Computer in Chemistry and Medicine Laboratory, Dhaka, Bangladesh, Department of Pharmacy, Comilla University, Comilla, Bangladesh

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• Nusrat Jahan,

  Roles Formal analysis, Writing – original draft

  Affiliations Department of Drug Design, Computer in Chemistry and Medicine Laboratory, Dhaka, Bangladesh, Department of Applied Chemistry and Chemical Engineering, University of Chittagong, Chattogram, Bangladesh

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• Nazmul Islam,

  Roles Formal analysis, Writing – original draft

  Affiliations Department of Drug Design, Computer in Chemistry and Medicine Laboratory, Dhaka, Bangladesh, Department of Chemistry, Bhawal Badre Alam Government College, Gazipur, Bangladesh

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• Mahbub Alam ,

  Contributed equally to this work with: Protyoi Chakraborty, Saithajit Mohajan, Mahbub Alam, Monir Uzzaman

  Roles Writing – review & editing

  Affiliation Department of Chemistry, Bangladesh Army University of Science and Technology Khulna, Khulna, Bangladesh

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• Monir Uzzaman

  Contributed equally to this work with: Protyoi Chakraborty, Saithajit Mohajan, Mahbub Alam, Monir Uzzaman

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Project administration, Supervision, Validation, Visualization, Writing – original draft, Writing – review & editing

  * E-mail: monircu92@gmail.com

  Affiliations Department of Drug Design, Computer in Chemistry and Medicine Laboratory, Dhaka, Bangladesh, Faculty of Science, Department of Chemistry, University of Chittagong, Chattogram, Bangladesh

  https://orcid.org/0000-0002-6887-9344

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