Elucidating Enzymatic Catalysis Using Fast Quantum Chemical Descriptors.
Igor Barden GrilloGabriel Aires Urquiza-CarvalhoJosé Fernando Ruggiero BachegaGerd Bruno RochaPublished in: J. Chem. Inf. Model. (2020)
Keyphrases
- quantum computing
- shape descriptors
- quantum computation
- data sets
- rotationally invariant
- quantum inspired
- distinctive features
- texture descriptors
- feature vectors
- image descriptors
- chemical compounds
- quantum mechanics
- high throughput
- keypoints
- sift descriptors
- low level
- shape context
- object retrieval
- visual descriptors
- chemical reactions
- multiscale
- neural network
- real time