# Towards Rational Design of Confined Catalysis in Carbon Nanotube by Machine Learning and Grand Canonical Monte Carlo Simulations

> Research article (Angewandte Chemie International Edition, 2024) · cited 17× · AI/ML

**Wikidata**: [openalex:W4405881213](https://www.wikidata.org/wiki/openalex:W4405881213)  
**Source**: https://4ort.xyz/entity/towards-rational-design-of-confined-catalysis-in-carbon-nanotube-by-machine-learning-and-grand-canonical-monte-carlo-sim