Comparative Analysis of pKa Predictions for Arsonic Acids Using Density Functional Theory-Based and Machine Learning Approaches
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Main Authors: | Miroslava Nedyalkova, Diana Heredia, Joaquín Barroso-Flores, Marco Lattuada |
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Format: | Article |
Language: | English |
Published: |
American Chemical Society
2025-01-01
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Series: | ACS Omega |
Online Access: | https://doi.org/10.1021/acsomega.4c10413 |
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