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Raúl Pérez-Soto

4 results in Authors: Raúl Pérez-Soto

Theoretical and Computational Chemistry

Enhancing Predictive Models for Solubility in Multicomponent Solvent Systems using Semi-Supervised Graph Neural Networks

Hojin Jung, Christopher D. Stubbs, Sabari Kumar, Raúl Pérez-Soto, Su-min Song, Yeonjoon Kim, Seonah Kim

Version 1 posted 27 December 2024

138

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rNets: A standalone package to visualize reaction networks.

Sergio Pablo-García, Raúl Pérez-Soto, Albert Sabadell-Rendón, Diego Garay-Ruiz, Vladyslav Nosylevskyi, Nuria López

Version 1 posted 03 April 2024

538

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Theoretical and Computational Chemistry

AQME: Automated Quantum Mechanical Environments for Researchers and Educators

Juan V. Alegre-Requena, Shree Sowndarya, Turki Alturaifi, Raúl Pérez-Soto, Robert Paton

Version 1 posted 25 October 2022

812

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1

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Chemical Engineering and Industrial Chemistry

The Sooting Behavior of Lactones as Sustainable Fuels

Zhanhong Xiang, Mehmet Acikel, Collin Hansen, Ga-Un Jeong, Seonah Kim, Charles McEnally, Raúl Pérez-Soto, Lisa Pfefferle, David Wang, Vivian Whoriskey, Yuan Xuan

Version 1 posted 08 July 2024

91

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1

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