Insights into the EGFR SAR of N-phenylquinazolin-4-amine-derivatives using quantum mechanical pairwise-interaction energies.
Saw SimeonNathjanan JongkonWarot ChotpatiwetchkulMatthew Paul GleesonPublished in: J. Comput. Aided Mol. Des. (2019)
Keyphrases
- pairwise
- higher order
- markov random field
- quantum mechanics
- high order
- parameter estimation
- human computer interaction
- multi class
- graph cuts
- similarity measure
- quantum computation
- image reconstruction
- synthetic aperture radar
- loss function
- quantum computing
- potential functions
- pairwise interactions
- spectral clustering
- sar images
- data mining
- higher order relations
- energy function
- semi supervised
- multiresolution
- image segmentation