Automatic creation of molecular substructures for accurate estimation of pure component properties using connectivity matrices

Keyphrases

• Accurate Estimation 100%
• Automatic Creation 100%
• Connectivity Matrix 100%
• Pure-component Property 100%
• Molecular Substructure 100%
• Submatrices 50%
• Molecular Features 50%
• Principal Coordinate Analysis (PCoA) 25%
• Prediction Model 25%
• Feature-based 25%
• Artificial Neural Network 25%
• Physicochemical Properties 25%
• Machine Learning Techniques 25%
• Machine Learning 25%
• Plethora 25%
• Matrix-based 25%
• Pearson Correlation Analysis 25%
• Chemical Processes 25%
• Molecule Structure 25%
• Network Process 25%
• Chemical Products 25%
• Pure Components 25%
• Molecular Information 25%
• Frequency Correlation 25%
• Pure Compounds 25%
• Structural Fragments 25%
• Normal Boiling Point 25%
• Extraction Strategies 25%
• Matrix Eigenvalues 25%
• Gaussian Process Regression 25%

Engineering

• Pure Component 100%
• Connectivity Matrix 100%
• Submatrix 50%
• Principal Components 25%
• Component Analysis 25%
• Artificial Neural Network 25%
• Gaussians 25%
• Machine Learning Method 25%
• Pearsons Linear Correlation Coefficient 25%
• Matrix Eigenvalue 25%
• Normal Boiling Point 25%

Chemical Engineering

• Learning System 100%
• Neural Network 50%