A GNN-Based QSPR Model for Surfactant Properties
Surfactants are among the most versatile molecules in the chemical industry because they can self-assemble in bulk solutions and at interfaces. Predicting the properties of surfactant solutions, such as their critical micelle concentration (CMC), limiting surface tension (<inline-formula><m...
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Main Authors: | Seokgyun Ham, Xin Wang, Hongwei Zhang, Brian Lattimer, Rui Qiao |
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Format: | Article |
Language: | English |
Published: |
MDPI AG
2024-11-01
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Series: | Colloids and Interfaces |
Subjects: | |
Online Access: | https://www.mdpi.com/2504-5377/8/6/63 |
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