About Us
The CSEC² (Computational Science & Engineering ,Computational Chemistry) Research Group at Istanbul Technical University brings together a dynamic, interdisciplinary team working at the interface of computational chemistry, biomolecular modeling, materials science, and data-driven scientific discovery.
Our research integrates quantum-mechanical methods, hybrid QM/MM simulations, molecular dynamics, multi-scale modeling, and machine-learning-enhanced approaches to address complex challenges in drug discovery, biomaterials design, and molecular medicine.