A Data Resource for Prediction of Gas-Phase Thermodynamic Properties of Small Molecules.
William BainsJanusz Jurand PetkowskiZhuchang ZhanSara SeagerPublished in: Data (2022)
Keyphrases
- data sets
- experimental data
- high quality
- data collection
- raw data
- metadata
- missing data
- data model
- computer systems
- small number
- data quality
- network structure
- prediction accuracy
- data processing
- image data
- knowledge discovery
- complex data
- small fraction
- original data
- information resources
- databases
- historical data
- correlation analysis
- data distribution
- genetic algorithm
- spatial data
- sensor data
- labeled data
- database
- semi supervised
- data points
- probability distribution
- artificial neural networks
- high dimensional
- data structure