Welcome to the Huang Research Group!

The main goal of our lab is to understand and manipulate biomolecular dynamics by developing and applying novel statistical mechanics based methods that can bridge the gap between experiments and simulations.

Examples of our interested research areas include elucidation of functional conformational changes in gene transcription, elucidation of molecular recognition and self-assembly, development of Markov State Model and Generalized Master Equation model for biomolecular dynamics, development of Integral Equation theories for solvation, and development of deep learning methods to predict protein-ligand and protein-RNA interactions.

Positions available!

Group News!

  • Sept 2021

    The Huang group attended the Hirschfelder Prize seminars and banquet! Congratulations on Prof. Sharon Hammes-Schiffer for winning the 2021-2022 Hirschfelder Prize!               Group photo at Hirschfelder banquet

  • Sept 2021

    The Huang group joined Department of Chemistry at UW-Madison! Xuhui is appointed as Hirschfelder Chair in Theoretical Chemistry.

  • Preview group news at HKUST

  • May 2021

    Congratulations on Peter for starting his own research group as a Tenure-track Assistant Professor at Chinese University of Hong Kong!

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