Molecular Docking ,Drug Discovery and Molecular Simulations Expert
Pakistan
Anglais
Certaines informations sont présentées en anglais.
À propos de moi
Computational Chemist (SBDD), (LBDD), and molecular dynamics (MD) simulations.
I help researchers, pharma startups, and academics accelerate their drug discovery pipelines by providing high-precision in silico screening and structural analysis.
Core Expertise:
Molecular Docking: Protein-ligand, protein-protein, and virtual screening of massive compound libraries.
Molecular Dynamics (MD).
ADMET Prediction: In silico evaluation of pharmacokinetics, toxicity, and drug-likeness (Lipinski’s Rule of 5).
Tools:
Docking: AutoDock Vina ,Material Studio , Gaussian
Visualization & Analysis: PyMOL.... Plus d’infos