Explainable Molecular Sets: Using Information Theory to Generate Meaningful Descriptions of Groups of Molecules

Social Sciences

• information theory 100%
• assortment 51%
• entropy 47%
• neural network 45%
• Open Sources 38%
• chemistry 33%
• Group 23%
• experiment 22%
• learning 13%

Engineering & Materials Science

• Information theory 88%
• Molecules 74%
• Unsupervised learning 29%
• Message passing 27%
• Interoperability 24%
• Network architecture 23%
• Labels 21%
• Entropy 21%
• Neural networks 15%
• Experiments 9%

Chemical Compounds

• Label 33%
• Entropy 31%
• Molecule 26%
• Molecular Cluster 24%
• Chemistry 22%