Dong Hao Lab
Kuang Yaming Honors School, Nanjing University
Computational work is felt to be more of art than science.
Just A Few Words
About us
The main research area of our group is to develop multi-scale computational simulation methods, combine them with machine learning algorithms, and study the physical and chemical properties of complex systems (such as proteins and other biological macromolecules, functional materials, self-organized structures, etc.).
Currently, our research mainly covers the following four aspects:
(1) The development of multi-scale simulation methods
(2) The study of structure, properties, and functions of biological macromolecules
(3) Calculation-driven design and application of functional materials
(4) Application of machine learning in complex systems.
Have A Look At The
Representative Publications
- A Two-ended DAta-Driven Accelerated Sampling Method for Exploring the Transition Pathways between Two Known States of Protein
J. Chem. Theory Comput. 2020 - Principles Governing Catalytic Activity of Self-assembled Short Peptides.
J. Am. Chem. Soc. 2019 - Towards a model for activation of Orai channel.
iScience 2019
These Are
Our Members
Contact
Prof. Hao DONG
+86-25-89681392
C210, Panqi Building
Kuang Yaming Honors School, Nanjing University.
163 Xianlin Ave, Qixia District, Nanjing, Jiangsu Province, China, 210023