Kick-Fukui: A Fukui Function-Guided Method for Molecular Structure Prediction.
Osvaldo YañezRodrigo Báez-GrezDiego InostrozaRicardo Pino-RiosWalter A. Rabanal-LeónJulia Contreras-GarciaCarlos CárdenasWilliam TiznadoPublished in: J. Chem. Inf. Model. (2021)
Keyphrases
- cost function
- preprocessing
- score function
- high precision
- high accuracy
- learning algorithm
- pairwise
- gaussian function
- prediction accuracy
- detection method
- optimization algorithm
- dynamic programming
- feature set
- computationally efficient
- probabilistic model
- optical flow
- synthetic data
- image processing
- machine learning
- data sets