Peichen Pan
Zhejiang Lab(CN)Pharmaceutical Biotechnology (Czechia)(CZ)Zhejiang University(CN)
Publications by Year
Research Areas
Computational Drug Discovery Methods, Protein Structure and Dynamics, Machine Learning in Materials Science, Protein Kinase Regulation and GTPase Signaling, Chemical Synthesis and Analysis
Most-Cited Works
- → Assessing the performance of MM/PBSA and MM/GBSA methods. 5. Improved docking performance using high solute dielectric constant MM/GBSA and MM/PBSA rescoring(2014)524 cited
- → Assessing the performance of the MM/PBSA and MM/GBSA methods. 6. Capability to predict protein–protein binding free energies and re-rank binding poses generated by protein–protein docking(2016)459 cited
- → Assessing the performance of MM/PBSA and MM/GBSA methods. 7. Entropy effects on the performance of end-point binding free energy calculation approaches(2018)348 cited
- → Boosting Protein–Ligand Binding Pose Prediction and Virtual Screening Based on Residue–Atom Distance Likelihood Potential and Graph Transformer(2022)172 cited
- → Chemistry-intuitive explanation of graph neural networks for molecular property prediction with substructure masking(2023)150 cited
- → Efficient and accurate large library ligand docking with KarmaDock(2023)139 cited