Generating eco-friendly ionic liquids with enhanced CO2 solubility using language models

Generating eco-friendly ionic liquids with enhanced CO2 solubility using language models

This study presents a viable approach for designing eco-friendly ionic liquids (ILs) with enhanced CO2 solubility using language models, specifically GPT-2 in conjunction with SMILES-X. The GPT-2 model was fine-tuned on a relatively small, unlabeled IL dataset and subsequently used to generate diver...

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Bibliographic Details
Main Authors: Adroit T.N. Fajar, Guillaume Lambard, Md. Amirul Islam, Bidyut B. Saha, Zakiah D. Nurfajrin, Kevin Septioga
Format: Article
Language:English
Published: Elsevier 2025-06-01
Series:Artificial Intelligence Chemistry
Subjects:
Generative model
GPT
Prediction
SMILES
Decarbonization
Online Access:http://www.sciencedirect.com/science/article/pii/S2949747725000065
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http://www.sciencedirect.com/science/article/pii/S2949747725000065

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