About Me
Hey! I am currently a postdoc research scientist in Prof. Yingkai Zhang's lab at New York Univeristy. I work on the improvement of Quantum-Chemical calculation with deep learning models.
Previously, I have developed new computational tools to understand protein-protein interactions using machine learning and molecular modeling during my Ph.D. study. I am interested in using data mining, data visualization, and machine learning to understand and solve problems.
My projects and software can be found in Projects page.
Publications
Improving Scoring-Docking-Screening Powers of Protein–Ligand Scoring Functions using Random Forest
C. Wang, and Y. Zhang,
J. Comput. Chem.,
38, 169-177
(2017).
AlphaSpace: Fragment-Centric Topographical Mapping to Target Protein-Protein Interaction Interfaces
D. W. Rooklin, C. Wang, J. Katigbak, P. S. Arora, and Y. Zhang,
J. Chem. Inf. Model., 55, 1585-1599
(2015).