57 citations · 182 across the 11 of their papers we have counts for
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physics.chem-ph2022
Enhanced sampling reveals the main pathway of an organic cascade reaction
Yi Sun, Xu Han, Lijiang Yang
Normal molecular dynamics simulations are usually unable to simulate chemical reactions due to the low probability of forming the transition state. Therefore, enhanced sampling met…
cs.LG2022★ 13 cited
Unsupervisedly Prompting AlphaFold2 for Few-Shot Learning of Accurate Folding Landscape and Protein Structure Prediction
Jun Zhang, Sirui Liu, Mengyun Chen +12
Data-driven predictive methods which can efficiently and accurately transform protein sequences into biologically active structures are highly valuable for scientific research and…
q-bio.BM2022★ 9 cited
PSP: Million-level Protein Sequence Dataset for Protein Structure Prediction
Sirui Liu, Jun Zhang, Haotian Chu +16
Proteins are essential component of human life and their structures are important for function and mechanism analysis. Recent work has shown the potential of AI-driven methods for…