Awesome AI for Science
📄
Papers
🧭
Topics
🔥
Trending
🗺️
Map
🏆
Leaderboards
🎓
Learn
🤖
Ask AI
⋯
More
👥
Authors
📚
Reading Packs
📊
Datasets
🛠️
Tools
📰
News
📝
Blogs
✉️
Newsletter
🎯
Research Radar
🔖
Saved
+ Add Paper
☾
☀
← authors
·
overview
Loading author…
🤖
Ask AI
Jiaqi Guan — most-cited papers & profile · AI for Science
← authors
·
overview
Jiaqi Guan
10
papers ·
213
citations ·
20
h-index
University of Illinois Urbana-Champaign · Changzhou University · University of Amsterdam
Google Scholar ↗
Semantic Scholar ↗
OpenAlex ↗
Most-cited papers
3D Equivariant Diffusion for Target-Aware Molecule Generation and Affinity Prediction
2023 · 80 citations
Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets
2022 · 79 citations
DecompDiff: Diffusion Models with Decomposed Priors for Structure-Based Drug Design
2024 · 26 citations
MolDiff: Addressing the Atom-Bond Inconsistency Problem in 3D Molecule Diffusion Generation
2023 · 11 citations
A 3D Generative Model for Structure-Based Drug Design
2022 · 7 citations
Orientation-Aware Graph Neural Networks for Protein Structure Representation Learning
2022 · 4 citations
Hotspot-Driven Peptide Design via Multi-Fragment Autoregressive Extension
2024 · 2 citations
Integrating Protein Dynamics into Structure-Based Drug Design via Full-Atom Stochastic Flows
2025
Group Ligands Docking to Protein Pockets
2025
Top co-authors
Jianzhu Ma
· 9
Jian Peng
· 4
Shitong Luo
· 4
Jiahan Li
· 3
Xingang Peng
· 3
Xiangxin Zhou
· 2
Chaoran Cheng
· 1
Chaoran Cheng
· 1
Congyue Deng
· 1
Feng Zhou
· 1
Ge Liu
· 1
Haowei Lin
· 1
Topics
Chemistry
Drug Discovery
Protein Science
Medical AI