Computational Chemistry - Gordon Research Conference

Topics: Molecular Modeling, Chemoinformatics, Physical Chemistry, Keywords: see below

Date: /22/23/24/25/26/27/ July 2018, West Dover (VT), USA, North America

More Information, Contact: wilson [at] chemistry.msu.edu (Prof. Angela Wilson)

  

Official Information:

The complexity of the challenges that computational chemistry methodologies are able to address is growing rapidly. Simulations are becoming increasingly accurate, while being able to access experimentally relevant timescales for large systems.

Topics

Accurate Predictions of Energetics for Biomolecules
Enhanced Sampling Towards Free Energy Calculations
From Data-Driven and Machine-Learning Based Discovery to Quantum Computing Challenges and Opportunities
Catalyst and Reaction Design
Strong Electron Correlation
Chemistry at the Interface
Quantum Chemistry
Reactivity and Interactions: Prediction and Control of Molecular Behavior
Advances Towards Drug Design