A physics-informed AI method for calculating melting points with uncertainty control and optimal sampling.
Olga KlimanovaTimofei MiryashkinAlexander ShapeevPublished in: CoRR (2023)
Keyphrases
- closed form
- detection method
- dynamic programming
- multiscale
- high accuracy
- classification accuracy
- support vector machine svm
- exhaustive search
- computational cost
- sampling methods
- preprocessing
- bayesian networks
- artificial intelligence
- control policy
- optimal control
- data sets
- control strategy
- parameter space
- high precision
- mathematical model
- distance function
- feature set
- edge detection
- control system
- similarity measure