Systematic Computational Design and Identification of Low Picomolar Inhibitors of Aurora Kinase A.
Hwangseo ParkHoi-Yun JungShinmee MahSungwoo HongPublished in: J. Chem. Inf. Model. (2018)
Keyphrases
- neural network
- design process
- user interface
- design methodology
- design decisions
- knowledge base
- decision making
- case study
- objective function
- multi agent
- pairwise
- databases
- data model
- object oriented
- artificial intelligence
- computer aided
- information retrieval
- machine learning
- protein protein interactions
- design tools
- design space
- automatic identification