Yaosen Min

发表

Molecular Graph Contrastive Learning with Parameterized Explainable Augmentations

Yingheng Wang, Yaosen Min, Erzhuo Shao, 2021, bioRxiv.

Yaosen Min, Xuefeng Cui, Shang Liu, .

External oxidant-free cross-coupling of arylcopper and alkynylcopper reagents leading to arylalkyne

Sheng Wang, C. Xi, Yaosen Min, 2017 .

Predicting the protein-ligand affinity from molecular dynamics trajectories

Jianyang Zeng, Stefan Bauer, N. Wu, 2022, ArXiv.

Homologous Protein Detection

Yaosen Min, Xuefeng Cui, Yaosen Min, 2019, Encyclopedia of Bioinformatics and Computational Biology.

Multi-view Graph Contrastive Representation Learning for Drug-Drug Interaction Prediction pdf

Xin Chen, Yingheng Wang, Yaosen Min, 2020, WWW.

MolCloze: A Unified Cloze-style Self-supervised Molecular Structure Learning Model for Chemical Property Prediction

Yingheng Wang, Yaosen Min, Ji Wu, 2021, 2021 IEEE International Conference on Bioinformatics and Biomedicine (BIBM).

Towards Predicting Equilibrium Distributions for Molecular Systems with Deep Learning

Chang Liu, Ziheng Lu, Shuxin Zheng, 2023, ArXiv.

Predicting the protein-ligand affinity from molecular dynamics trajectories

Jianyang Zeng, Ji Wu, Stefan Bauer, 2022, ArXiv.

From Static to Dynamic Structures: Improving Binding Affinity Prediction with a Graph-Based Deep Learning Model

Jianyang Zeng, Ji Wu, Stefan Bauer, 2022, 2208.10230.

Learning Protein Structural Fingerprints under the Label-Free Supervision of Domain Knowledge

Yaosen Min, Xuefeng Cui, Shang Liu, 2018, bioRxiv.

A knowledge-guided pre-training framework for improving molecular representation learning

Dan Zhao, Yaosen Min, Han Li, 2023, Nature communications.

Molecule Generation For Target Protein Binding with Structural Motifs

Zaixin Zhang, Qi Liu, Shuxin Zheng, 2023, ICLR.

Masked Molecule Modeling: A New Paradigm of Molecular Representation Learning for Chemistry Understanding

Liwei Wang, Shuxin Zheng, Yaosen Min, 2022 .