Search

Categories

Energy

(1)

Physical Chemistry

(2)

Theoretical and Computational Chemistry

(4)

Content Types

Working Paper

(4)

Keywords

Authors

Yu-Hang Tang

4 results in Authors: Yu-Hang Tang

Theoretical and Computational Chemistry

Interpretable Molecular Property Predictions Using Marginalized Graph Kernels

Yan Xiang, Yu-Hang Tang, Guang Lin, Daniel Reker

Version 1 posted 20 February 2023

507

Downloads

Theoretical and Computational Chemistry

A Comparative Study of Marginalized Graph Kernel and Message Passing Neural Network

Yan Xiang, Yu-Hang Tang, Guang Lin, Huai Sun

Version 2 posted 21 July 2021

793

Downloads

Physical Chemistry

Predicting Single-Substance Phase Diagrams: A Kernel Approach on Graph Representations of Molecules

Yan Xiang, Yu-Hang Tang, Hongyi Liu, Guang Lin, Huai Sun

Version 1 posted 03 March 2021

447

Downloads

Soaring Chemical Space of Battery Electrolytes Using Universal Machine Learning Potential

Feng Wang, Yu-Hang Tang, Ze-Bing Ma, Yu-Cheng Jin, Jun Cheng

Version 1 posted 03 March 2025

338

Downloads