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Thiadiazine thione derivatives as anti-leishmanial agents: synthesis, biological evaluation, structure activity relationship, ADMET, molecular docking and molecular dynamics simulation studies.
Fu, Chaoping; Qadir, Meshil; Shah, Muhammad Ishaq Ali; Shtaiwi, Amneh; Khan, Rasool; Khan, Shafi Ullah; Htar, Thet Thet; Zada, Amir; Lodhi, Muhammad Arif; Ateeq, Muhammad; Ali, Arif; Naeem, Mohammad; Ibrahim, Mohammad; Khan, Sher Wali.
Affiliation
  • Tamanna; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Fu C; Institute of Biomaterials and Tissue Engineering, Huaqiao University, Xiamen, P.R. China.
  • Qadir M; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Shah MIA; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Shtaiwi A; School of Pharmacy, Middle East University, Amman, Jordan.
  • Khan R; Institute of Chemical Sciences, University of Peshawar, Peshawar, Pakistan.
  • Khan SU; School of Pharmacy, Monash University Malaysia, Subang Jaya, Selangor, Malaysia.
  • Htar TT; School of Pharmacy, Monash University Malaysia, Subang Jaya, Selangor, Malaysia.
  • Zada A; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Lodhi MA; Department of Biochemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Ateeq M; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Ali A; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Naeem M; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Ibrahim M; Department of Chemistry, Abdul Wali Khan University, Mardan, Pakistan.
  • Khan SW; Department of Chemistry, Shaheed Benazir Bhutto University, Sheringal Upper Dir, Pakistan.
J Biomol Struct Dyn ; : 1-15, 2023 Aug 07.
Article in En | MEDLINE | ID: mdl-37551015
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Biomol Struct Dyn Year: 2023 Document type: Article Affiliation country: Country of publication:
Fulltext
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Biomol Struct Dyn Year: 2023 Document type: Article Affiliation country: Country of publication: