Structured Multi-task Learning for Molecular Property Prediction

Structured Multi-task Learning for Molecular Property Prediction

22 February 2022

Jian Tang

Papers citing "Structured Multi-task Learning for Molecular Property Prediction"

13 / 13 papers shown

Title
Multi-Hierarchical Fine-Grained Feature Mapping Driven by Feature Contribution for Molecular Odor Prediction Hong Xin Xie Jian De Sun Fan Fu Xue Zi Fei Han S. Feng Qi Chen 53 0 0 01 May 2025
Data Fusion of Deep Learned Molecular Embeddings for Property Prediction Robert Appleton Brian C Barnes Alejandro Strachan FedML AI4CE 37 0 0 09 Apr 2025
Geometrically Aligned Transfer Encoder for Inductive Transfer in Regression Tasks Sung Moon Ko Sumin Lee Dae-Woong Jeong Woohyung Lim Sehui Han 18 3 0 10 Oct 2023
3D Denoisers are Good 2D Teachers: Molecular Pretraining via Denoising and Cross-Modal Distillation Sungjun Cho Dae-Woong Jeong Sung Moon Ko Jinwoo Kim Sehui Han Seunghoon Hong Honglak Lee Moontae Lee AI4CE DiffM 35 1 0 08 Sep 2023
Learning to Group Auxiliary Datasets for Molecule Ting Huang Ziniu Hu Rex Ying 11 0 0 08 Jul 2023
Multi-Task Learning with Loop Specific Attention for CDR Structure Prediction Eleni Giovanoudi Dimitrios Rafailidis 16 1 0 22 Jun 2023
Symmetry-Informed Geometric Representation for Molecules, Proteins, and Crystalline Materials Shengchao Liu Weitao Du Yanjing Li Zhuoxinran Li Zhiling Zheng ... Anima Anandkumar C. Borgs J. Chayes Hongyu Guo Jian Tang AI4CE 33 20 0 15 Jun 2023
Knowledge-augmented Graph Machine Learning for Drug Discovery: A Survey from Precision to Interpretability Zhiqiang Zhong A. Barkova Davide Mottin 24 8 0 16 Feb 2023
A Text-guided Protein Design Framework Shengchao Liu Yanjing Li Zhuoxinran Li A. Gitter Yutao Zhu ... Arvind Ramanathan Chaowei Xiao Jian Tang Hongyu Guo Anima Anandkumar 70 61 0 09 Feb 2023
Improving Domain Generalization with Domain Relations Huaxiu Yao Xinyu Yang Xinyi Pan Shengchao Liu Pang Wei Koh Chelsea Finn OOD AI4CE 52 8 0 06 Feb 2023
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
Attentive Walk-Aggregating Graph Neural Networks M. F. Demirel Shengchao Liu Siddhant Garg Zhenmei Shi Yingyu Liang 92 10 0 06 Oct 2021
MoleculeNet: A Benchmark for Molecular Machine Learning Zhenqin Wu Bharath Ramsundar Evan N. Feinberg Joseph Gomes C. Geniesse Aneesh S. Pappu K. Leswing Vijay S. Pande OOD 219 1,780 0 02 Mar 2017