Mapping partial agonism of mitragynine at the µ-opioid receptor through molecular dynamics and Markov state modelling analysis.
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| Title: | Mapping partial agonism of mitragynine at the µ-opioid receptor through molecular dynamics and Markov state modelling analysis. |
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| Authors: | Bahari MNA; Collaborative Microelectronic Design Excellence Center (CEDEC), Universiti Sains Malaysia, No. 10, Persiaran Bukit Jambul, 11900, Bayan Lepas, Pulau Pinang, Malaysia., Azmi L; Faculty of Medicine and Health Sciences, Universiti Sains Islam Malaysia, 71800, Nilai, Negeri Sembilan, Malaysia., Fei LC; Institute of Systems Biology, Universiti Kebangsaan Malaysia (UKM), 43600, Bangi, Selangor, Malaysia., Syahir A; Nanobiotechnology Research Group, Department of Biochemistry, Faculty of Biotechnology and Biomolecular Sciences, Universiti Putra Malaysia (UPM), 43400, Serdang, Selangor, Malaysia., Perimal E; Curtin Medical School, Faculty of Health Sciences, Curtin University, Kent St, Bentley, WA, 6102, Australia., Manaf AA; Collaborative Microelectronic Design Excellence Center (CEDEC), Universiti Sains Malaysia, No. 10, Persiaran Bukit Jambul, 11900, Bayan Lepas, Pulau Pinang, Malaysia., Jamali MAM; Faculty of Science and Technology, Universiti Sains Islam Malaysia, 71800, Nilai, Negeri Sembilan, Malaysia. arifjamali@usim.edu.my. |
| Source: | Scientific reports [Sci Rep] 2026 Mar 07; Vol. 16 (1). Date of Electronic Publication: 2026 Mar 07. |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE |
| Database: | MEDLINE Ultimate |
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