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Osman Gani

Associate Professor

University of Oslo

Oslo, Norway

Organisation from Academic Sector

University of Oslo, Department of Pharmacy: AI/ML virtual screening and FEP/MD free-energy workflows for antimicrobial and peptide drug discovery. Seeks MSCA-DN Beneficiary role; will host 1–2 DCs and lead a work package on computational lead discovery.

My organisation

University of Oslo
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About me

I am an Associate Professor of Computational Medicinal Chemistry at the University of Oslo, Department of Pharmacy, where I lead a research group in structure-based and AI-assisted drug discovery. My work integrates virtual screening, molecular docking, and rigorous free-energy methods (ABFE/RBFE) to identify and optimize small-molecule and peptide ligands for therapeutically important targets, including G protein-coupled receptors and inflammation-resolving systems. I develop and maintain open-source computational tools, including BAT.py (automated ABFE/RBFE binding free-energy workflows) and FEP-SPell (a free-energy perturbation pipeline), built on AMBER, GROMACS and OpenMM and designed for reproducible, FAIR-aligned drug discovery. In the MSCA-DN context, I offer doctoral candidate hosting at UiO, hands-on supervision in computational chemistry, and an end-to-end workflow spanning ligand design, GPU-accelerated molecular dynamics, and free-energy validation. I am particularly interested in consortia focusing on antimicrobial resistance, peptide therapeutics, and inflammation and pain biology.

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Skills

  • Virtual Screening
  • Molecular Docking
  • Molecular Dynamics Simulations
  • Free energy calculations (FEP, ABFE, RBFE)
  • AI/ML for drug discovery
  • Structure-based Drug Design
  • medicinal chemistry
  • GPCR drug discovery
  • Kinase drug discovery
  • peptide therapeutics
  • Antimicrobial drug discovery
  • FAIR data and reproducible workflows
  • PhD supervision

Interests

  • Antimicrobial resistance (AMR)
  • Peptide drug design
  • GPCR pharmacology
  • Opioid receptor signaling
  • Inflammation resolution
  • Specialized pro-resolving mediators (SPMs)
  • Pain and analgesia
  • AI/ML in drug discovery
  • Free energy methods (FEP)
  • FAIR data in life sciences
  • Doctoral training networks (MSCA-DN)
  • Open-source scientific software

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