Evaluation of Interaction Level between Potential Drug and Protein by Hydrogen Bond Energy Calculation.
Ekaterina TyulkinaPavel VassilievTimur JanovskyMaxim ShcherbakovPublished in: JCKBSE (2014)
Keyphrases
- drug discovery
- drug design
- human computer interaction
- chemical compounds
- higher level
- energy consumption
- neural network
- pharmaceutical industry
- protein interaction
- protein structure prediction
- user interaction
- steady state
- protein sequences
- amino acids
- physico chemical
- calculation method
- coarse grained
- protein structure