FORTE Computational Chemistry Lab operates within the Department of Drug and Health Sciences at the University of Catania. Coordinated by Prof. Giuseppe Forte, the laboratory develops and applies computational methods to investigate molecular mechanisms, materials and complex chemical systems, maintaining a strong connection between theoretical predictions and experimental evidence.

Our work combines fundamental chemical understanding, advanced computational methodologies and close interaction with experimental research.
We investigate how electronic structure, molecular interactions and conformational dynamics determine observable chemical and physical behavior.
Quantum chemistry, molecular dynamics, multiscale modeling and data-analysis tools are combined according to the scientific question.
Computational results are developed in dialogue with experimental evidence to support interpretation, validation and new research directions.
Our mission is to use computational chemistry to understand molecular mechanisms, predict measurable properties and guide the rational design of molecules, materials and complex chemical systems.
We approach each scientific question by selecting the most appropriate combination of theoretical methods, simulation techniques and data-analysis tools, maintaining a strong connection between computational predictions and experimental evidence.
FORTE Computational Chemistry Lab operates within the Department of Drug and Health Sciences at the University of Catania and contributes to research, scientific collaboration and knowledge transfer.
University of Catania
Department of Drug and Health Sciences
Scientific Coordinator: Prof. Giuseppe Forte

Associate Professor of General and Inorganic Chemistry
Department of Drug and Health Sciences · University of Catania
Giuseppe Forte’s research focuses on the application and integration of quantum-chemical calculations, molecular dynamics and multiscale modeling to investigate molecular systems, functional materials, biomolecular interactions and responsive nanostructures. He coordinates the laboratory’s scientific activities and collaborative computational projects.
Our computational research is organized around scientific rigor, methodological clarity, reproducibility and constructive collaboration.
Methods and computational protocols are selected according to the scientific question, the molecular system and the required level of accuracy.
Calculations, simulations and analysis procedures are structured and documented to support verification, comparison and progressive refinement.
Computational results are translated into measurable properties, mechanistic interpretations and experimentally testable hypotheses.
Projects are developed through clear scientific dialogue and responsible handling of research information, data and results.
We can help you identify the most suitable methods, software tools and computational resources for accurate, efficient and reproducible results.