Li Rao

Orcid: 0000-0002-0780-6504

Affiliations:
  • Central China Normal University, Key Laboratory of Pesticide & Chemical Biology, CCNU, Wuhan, China
  • Fudan University, MOE Laboratory for Computational Physical Science, Shanghai, China


According to our database1, Li Rao authored at least 5 papers between 2013 and 2023.

Collaborative distances:
  • Dijkstra number2 of four.
  • Erdős number3 of four.

Timeline

Legend:

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PhD thesis 
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Links

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Bibliography

2023
DOX_BDW: Incorporating Solvation and Desolvation Effects of Cavity Water into Nonfitting Protein-Ligand Binding Affinity Prediction.
J. Chem. Inf. Model., August, 2023

2020
Cov_FB3D: A De Novo Covalent Drug Design Protocol Integrating the BA-SAMP Strategy and Machine-Learning-Based Synthetic Tractability Evaluation.
J. Chem. Inf. Model., 2020

2017
Structure-Based Rational Design of Novel Inhibitors Against Fructose-1,6-Bisphosphate Aldolase from <i>Candida albicans</i>.
J. Chem. Inf. Model., June, 2017

2016
DOX: A new computational protocol for accurate prediction of the protein-ligand binding structures.
J. Comput. Chem., 2016

2013
Nonfitting protein-ligand interaction scoring function based on first-principles theoretical chemistry methods: Development and application on kinase inhibitors.
J. Comput. Chem., 2013


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