Protein-Ligand Interaction Prior for Binding-aware 3D Molecule Diffusion Models.
Zhilin HuangLing YangXiangxin ZhouZhilong ZhangWentao ZhangXiawu ZhengJie ChenYu WangBin CuiWenming YangPublished in: ICLR (2024)
Keyphrases
- diffusion models
- drug discovery
- drug design
- virtual screening
- diffusion model
- information diffusion
- protein interaction
- dna binding
- protein protein
- social networks
- amino acids
- influence maximization
- protein structure
- protein sequences
- protein structure prediction
- binding sites
- communication networks
- transcription factor binding sites
- online social networks
- gene expression