Hanine Hadni

Research Associate in computational chemistry and computer-aided drug design (CADD), focused on molecular modeling, QSAR, pharmacophore modeling, docking, molecular dynamics, ADMET prediction, and scientific data analysis.

Main contributions:

• Developed and validated QSAR and pharmacophore models for bioactive compounds.

• Performed molecular docking and protein–ligand interaction analysis.

• Conducted molecular dynamics simulations and trajectory analysis using GROMACS/NAMD.

• Applied ADMET, DFT, and hybrid AI/ML approaches to support lead optimization.

• Contributed to peer-reviewed publications, manuscript writing, data interpretation, and student supervision.

This experience strengthened my ability to deliver clear, reproducible, and decision-oriented computational results for drug discovery projects.

• Conducting advanced computational chemistry and molecular modeling research.

• Expertise in pharmacophore modeling, 3D-QSAR, molecular docking, molecular dynamics simulations (GROMACS/NAMD), ADMET predictions, DFT calculations, and hybrid AI–MD approaches.

• Research axes focused on molecular modeling and computer-aided design of novel anticancer drug candidates.

• Collaborating with faculty members from INTI International University (Malaysia) and FSDM (Morocco) on multidisciplinary research projects and publications.

• Supervising postgraduate researchers and contributing to scientific training and methodology.

• Participating in the organization of scientific events, conferences, and research symposia.

• Providing research consultancy and supporting the development and review of academic and research programs.

• Utilizing university research facilities to deliver high-quality outputs and disseminating results through publications and presentations