Jia, Yinjun
- DrugCLIP: Contrastive Protein-Molecule Representation Learning for Virtual Screening
2023/10/10 by Bowen Gao, Gao, Bowen, Qiang Bo +15 · 13 citations
Computer Science · Biochemistry, Genetics and Molecular Biology · #Computational Drug Discovery Methods #vaccines and immunoinformatics approaches #Protein Structure and Dynamics
- Full-Atom Peptide Design with Geometric Latent Diffusion
2024/02/21 by Xiangzhe Kong, Kong, Xiangzhe, Wenbing Huang +4 · 9 citations
Biochemistry, Genetics and Molecular Biology · Materials Science · Physics and Astronomy · #Advanced Chemical Physics Studies #Biomolecules (q-bio.BM) #Chemical Synthesis and Analysis #FOS: Biological sciences #Machine Learning in Materials Science
- Protein-ligand binding representation learning from fine-grained interactions
2023/11/09 by Shikun Feng, Minghao Li, Feng, Shikun +7 · 4 citations
Computer Science · Biochemistry, Genetics and Molecular Biology · Materials Science · #Computational Drug Discovery Methods #Protein Structure and Dynamics #Machine Learning in Materials Science
- Multi-level Interaction Modeling for Protein Mutational Effect Prediction
2024/05/28 by Mo, Yuanle, Hong, Xin, Gao, Bowen +2 · 3 citations
#Artificial Intelligence (cs.AI) #Biomolecules (q-bio.BM) #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG)
- ProFSA: Self-supervised Pocket Pretraining via Protein Fragment-Surroundings Alignment
2023/10/11 by Bowen Gao, Gao, Bowen, Yinjun Jia +11 · 2 citations
Biochemistry, Genetics and Molecular Biology · Computer Science · #Chemical Synthesis and Analysis #Computational Drug Discovery Methods #FOS: Computer and information sciences #Machine Learning (cs.LG) #Protein Structure and Dynamics