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Molecular Geometry-aware Transformer for accurate 3D Atomic System
  modeling

Molecular Geometry-aware Transformer for accurate 3D Atomic System modeling

2 February 2023
Zheng Yuan
Yaoyun Zhang
Chuanqi Tan
Wei Wang
Feiran Huang
Songfang Huang
    AI4CE
    ViT
ArXivPDFHTML

Papers citing "Molecular Geometry-aware Transformer for accurate 3D Atomic System modeling"

4 / 4 papers shown
Title
Triplet Interaction Improves Graph Transformers: Accurate Molecular
  Graph Learning with Triplet Graph Transformers
Triplet Interaction Improves Graph Transformers: Accurate Molecular Graph Learning with Triplet Graph Transformers
Md Shamim Hussain
Mohammed J. Zaki
D. Subramanian
ViT
26
4
0
07 Feb 2024
Spherical Channels for Modeling Atomic Interactions
Spherical Channels for Modeling Atomic Interactions
C. L. Zitnick
Abhishek Das
Adeesh Kolluru
Janice Lan
Muhammed Shuaibi
Anuroop Sriram
Zachary W. Ulissi
Brandon M. Wood
79
58
0
29 Jun 2022
Equiformer: Equivariant Graph Attention Transformer for 3D Atomistic
  Graphs
Equiformer: Equivariant Graph Attention Transformer for 3D Atomistic Graphs
Yi-Lun Liao
Tess E. Smidt
75
213
0
23 Jun 2022
The Open Catalyst 2020 (OC20) Dataset and Community Challenges
The Open Catalyst 2020 (OC20) Dataset and Community Challenges
L. Chanussot
Abhishek Das
Siddharth Goyal
Thibaut Lavril
Muhammed Shuaibi
...
Brandon M. Wood
Junwoong Yoon
Devi Parikh
C. L. Zitnick
Zachary W. Ulissi
221
500
0
20 Oct 2020
1