Identification of Pak1 inhibitors using water thermodynamic analysis. [electronic resource]
Producer: 20201224Description: 13-31 p. digitalISSN:- 1538-0254
- Binding Sites
- Drug Design
- Drug Evaluation, Preclinical
- Hydrogen Bonding
- Ligands
- Molecular Docking Simulation
- Molecular Dynamics Simulation
- Molecular Structure
- Protein Binding
- Protein Kinase Inhibitors -- chemistry
- Quantitative Structure-Activity Relationship
- Reproducibility of Results
- Thermodynamics
- Water -- chemistry
- p21-Activated Kinases -- antagonists & inhibitors
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Publication Type: Journal Article; Research Support, Non-U.S. Gov't
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