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A Crystal-Specific Pre-Training Framework for Crystal Material Property
  Prediction

A Crystal-Specific Pre-Training Framework for Crystal Material Property Prediction

8 June 2023
Haomin Yu
Yanru Song
Jilin Hu
Chenjuan Guo
B. Yang
    AI4CE
ArXivPDFHTML

Papers citing "A Crystal-Specific Pre-Training Framework for Crystal Material Property Prediction"

4 / 4 papers shown
Title
A Survey of Geometric Graph Neural Networks: Data Structures, Models and Applications
A Survey of Geometric Graph Neural Networks: Data Structures, Models and Applications
Jiaqi Han
Jiacheng Cen
Liming Wu
Zongzhao Li
Xiangzhe Kong
...
Zhewei Wei
Deli Zhao
Yu Rong
Wenbing Huang
Wenbing Huang
AI4CE
34
20
0
01 Mar 2024
Periodic Graph Transformers for Crystal Material Property Prediction
Periodic Graph Transformers for Crystal Material Property Prediction
Keqiang Yan
Yi Liu
Yu-Ching Lin
Shuiwang Ji
AI4TS
88
84
0
23 Sep 2022
Crystal Diffusion Variational Autoencoder for Periodic Material
  Generation
Crystal Diffusion Variational Autoencoder for Periodic Material Generation
Tian Xie
Xiang Fu
O. Ganea
Regina Barzilay
Tommi Jaakkola
DiffM
BDL
212
232
0
12 Oct 2021
Pre-training Molecular Graph Representation with 3D Geometry
Pre-training Molecular Graph Representation with 3D Geometry
Shengchao Liu
Hanchen Wang
Weiyang Liu
Joan Lasenby
Hongyu Guo
Jian Tang
126
302
0
07 Oct 2021
1