104 citations · 113 across the 4 of their papers we have counts for
4 papers
BioScore: A Foundational Scoring Function For Diverse Biomolecular Complexes
Yuchen Zhu, Jihong Chen, Yitong Li +9
Structural assessment of biomolecular complexes is vital for translating molecular models into functional insights, shaping our understanding of biology and aiding drug discovery.…
Pre-Training on Large-Scale Generated Docking Conformations with HelixDock to Unlock the Potential of Protein-ligand Structure Prediction Models
Lihang Liu, Shanzhuo Zhang, Donglong He +12
Protein-ligand structure prediction is an essential task in drug discovery, predicting the binding interactions between small molecules (ligands) and target proteins (receptors). R…
GEM-2: Next Generation Molecular Property Prediction Network by Modeling Full-range Many-body Interactions
Lihang Liu, Donglong He, Xiaomin Fang +4
Molecular property prediction is a fundamental task in the drug and material industries. Physically, the properties of a molecule are determined by its own electronic structure, wh…
HelixFold-Single: MSA-free Protein Structure Prediction by Using Protein Language Model as an Alternative
Xiaomin Fang, Fan Wang, Lihang Liu +7
AI-based protein structure prediction pipelines, such as AlphaFold2, have achieved near-experimental accuracy. These advanced pipelines mainly rely on Multiple Sequence Alignments…