Key Dates

Pre-registration deadline : May, 7th (after Aprll 15th the rooms are not guaranteed)

Workshop :

• Online session on Wednesday May 13th (9 am – 12 am and 1pm-2:30pm for troubleshooting)
• In person session from May 18th to May 22nd (recommended arrival : Sunday May 17th)

Exploring Molecular Systems

Computational chemistry stands at the crossroads of chemistry and physics, offering a window into the atomic-scale behavior of molecules, their assemblies, and their transformations through reactions, dynamics, and light–matter interactions.

Recent advances in hardware and software have revolutionized our ability to model, simulate, and visualize chemical phenomena, from IR and UV spectra to complex reaction mechanisms. Yet, limited training in specialized tools still hinders broader adoption, highlighting the need for more accessible and interactive learning environments.

Jupyter Notebooks Tools

Jupyter Notebooks, integrated with platforms such as VeloxChem, create an intuitive and engaging space for exploring molecular behavior interactively. Participants gain hands-on experience visualizing electronic transitions, conformational dynamics, and other key processes as they unfold.

An Immersive and Collaborative Experience

• The school includes an online session held the week prior to the in-person event (the link will be sent in due time).
• Combining theory with intensive practice, participants progress step by step under direct expert guidance — learning not only how to use advanced tools, but why they work.
• Beyond traditional lectures, this immersive approach encourages participants to experiment interactively, ask real-time questions, and collaborate with peers facing similar challenges.
• By bringing together researchers from diverse disciplines, the program sparks interdisciplinary dialogue, strengthens computational skills, and builds a community ready to advance molecular science.

More information