Lv11
28 积分 2022-02-15 加入
3D molecular generation models expand chemical space exploration in drug design
27天前
已完结
PocketFlow is a data-and-knowledge-driven structure-based molecular generative model
1个月前
已完结
Generating 3D small binding molecules using shape-conditioned diffusion models with guidance
1个月前
已完结
ECloudGen: leveraging electron clouds as a latent variable to scale up structure-based molecular design
1个月前
已完结
A generative deep learning approach to de novo antibiotic design
1个月前
已完结
Bridging three-dimensional molecular structures and artificial intelligence with a conformation description language
1个月前
已完结
Modeling protein–ligand interactions for drug discovery in the era of deep learning
9个月前
已完结
Toxicological data bank bridges the gap between environmental risk assessment and green organic chemical design in One Health world
9个月前
已完结
Benchmarking AI-powered docking methods from the perspective of virtual screening
10个月前
已完结
Protein–peptide docking with a rational and accurate diffusion generative model
11个月前
已完结