Exploring the effect of aplidin on low molecular weight protein tyrosine phosphatase by molecular docking and molecular dynamic simulation study.
Ying-Zhan SunJing-Wei WuXin-Hua LuYing MaRun-Ling WangPublished in: Comput. Biol. Chem. (2019)
Keyphrases
- simulation study
- molecular structures
- drug discovery
- molecular dynamics
- virtual screening
- three dimensional
- drug design
- protein structure prediction
- sequence analysis
- molecular dynamics simulations
- protein protein
- molecular structure
- van der waals
- data sets
- hiv protease
- chemical reactions
- dna computing
- mass spectrometry
- protein protein interactions
- protein function prediction
- signaling pathways