Picture for Kelin Xia

Kelin Xia

KA-GNN: Kolmogorov-Arnold Graph Neural Networks for Molecular Property Prediction

Add code
Oct 15, 2024
Viaarxiv icon

Molecular topological deep learning for polymer property prediction

Add code
Oct 07, 2024
Figure 1 for Molecular topological deep learning for polymer property prediction
Figure 2 for Molecular topological deep learning for polymer property prediction
Figure 3 for Molecular topological deep learning for polymer property prediction
Figure 4 for Molecular topological deep learning for polymer property prediction
Viaarxiv icon

Topology-enhanced machine learning model (Top-ML) for anticancer peptide prediction

Add code
Jul 12, 2024
Viaarxiv icon

Graph Neural Networks with a Distribution of Parametrized Graphs

Add code
Oct 28, 2023
Viaarxiv icon

Curvature-enhanced Graph Convolutional Network for Biomolecular Interaction Prediction

Add code
Jun 23, 2023
Viaarxiv icon

Torsion Graph Neural Networks

Add code
Jun 23, 2023
Viaarxiv icon

Molecular geometric deep learning

Add code
Jun 22, 2023
Viaarxiv icon

Persistent spectral based machine learning (PerSpect ML) for drug design

Add code
Feb 03, 2020
Figure 1 for Persistent spectral based machine learning (PerSpect ML) for drug design
Figure 2 for Persistent spectral based machine learning (PerSpect ML) for drug design
Figure 3 for Persistent spectral based machine learning (PerSpect ML) for drug design
Figure 4 for Persistent spectral based machine learning (PerSpect ML) for drug design
Viaarxiv icon