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Pre-training with Fractional Denoising to Enhance Molecular Property
  Prediction

Pre-training with Fractional Denoising to Enhance Molecular Property Prediction

14 July 2024
Yuyan Ni
Shikun Feng
Xin Hong
Yuancheng Sun
Wei-Ying Ma
Zhiming Ma
Qiwei Ye
Yanyan Lan
    AI4CE
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Papers citing "Pre-training with Fractional Denoising to Enhance Molecular Property Prediction"

7 / 7 papers shown
Title
NaFM: Pre-training a Foundation Model for Small-Molecule Natural Products
NaFM: Pre-training a Foundation Model for Small-Molecule Natural Products
Yuheng Ding
Bo Qiang
Yiran Zhou
Jie Yu
Qi Li
Liangren Zhang
Yusong Wang
Zhenmin Liu
249
0
0
22 Mar 2025
UniGEM: A Unified Approach to Generation and Property Prediction for Molecules
UniGEM: A Unified Approach to Generation and Property Prediction for Molecules
Shikun Feng
Yuyan Ni
Yan Lu
Zhi-Ming Ma
Wei-Ying Ma
Yanyan Lan
45
5
0
14 Oct 2024
Geometric Representation Condition Improves Equivariant Molecule Generation
Geometric Representation Condition Improves Equivariant Molecule Generation
Zian Li
Cai Zhou
Xiyuan Wang
Xingang Peng
Muhan Zhang
50
2
0
04 Oct 2024
Masked Autoencoders Are Scalable Vision Learners
Masked Autoencoders Are Scalable Vision Learners
Kaiming He
Xinlei Chen
Saining Xie
Yanghao Li
Piotr Dollár
Ross B. Girshick
ViT
TPM
322
7,503
0
11 Nov 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
304
0
07 Oct 2021
Multilingual Molecular Representation Learning via Contrastive
  Pre-training
Multilingual Molecular Representation Learning via Contrastive Pre-training
Zhihui Guo
P. Sharma
Andy Martinez
Liang Du
Robin Abraham
43
29
0
18 Sep 2021
Robust Optimization as Data Augmentation for Large-scale Graphs
Robust Optimization as Data Augmentation for Large-scale Graphs
Kezhi Kong
Ge Li
Mucong Ding
Zuxuan Wu
Chen Zhu
Guohao Li
Gavin Taylor
Tom Goldstein
106
75
0
19 Oct 2020
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