Gibbs-Helmholtz Graph Neural Network: capturing the temperature dependency of activity coefficients at infinite dilution

2 December 2022

Papers citing "Gibbs-Helmholtz Graph Neural Network: capturing the temperature dependency of activity coefficients at infinite dilution"

3 / 3 papers shown

Title
GRAPPA - A Hybrid Graph Neural Network for Predicting Pure Component Vapor Pressures Marco Hoffmann Hans Hasse F. Jirasek 43 1 0 15 Jan 2025
GraphXForm: Graph transformer for computer-aided molecular design Jonathan Pirnay Jan G. Rittig Alexander B. Wolf Martin Grohe Jakob Burger Alexander Mitsos D. G. Grimm AI4CE 51 1 0 03 Nov 2024
Machine Learning in Thermodynamics: Prediction of Activity Coefficients by Matrix Completion F. Jirasek Rodrigo Alves J. Damay Robert A. Vandermeulen Robert Bamler Michael Bortz Stephan Mandt Marius Kloft Hans Hasse 160 67 0 29 Jan 2020