Search Results for author: Qinghe Gao

Found 6 papers, 1 papers with code

MachineLearnAthon: An Action-Oriented Machine Learning Didactic Concept

no code implementations29 Jan 2024 Michal Tkáč, Jakub Sieber, Lara Kuhlmann, Matthias Brueggenolte, Alexandru Rinciog, Michael Henke, Artur M. Schweidtmann, Qinghe Gao, Maximilian F. Theisen, Radwa El Shawi

Machine Learning (ML) techniques are encountered nowadays across disciplines, from social sciences, through natural sciences to engineering.

Deep reinforcement learning for process design: Review and perspective

no code implementations15 Aug 2023 Qinghe Gao, Artur M. Schweidtmann

The transformation towards renewable energy and feedstock supply in the chemical industry requires new conceptual process design approaches.

Decision Making reinforcement-learning

Flowsheet synthesis through hierarchical reinforcement learning and graph neural networks

no code implementations25 Jul 2022 Laura Stops, Roel Leenhouts, Qinghe Gao, Artur M. Schweidtmann

In particular, the graph neural networks are implemented within the agent architecture to process the states and make decisions.

Chemical Process Decision Making +3

Graph neural networks for the prediction of molecular structure-property relationships

no code implementations25 Jul 2022 Jan G. Rittig, Qinghe Gao, Manuel Dahmen, Alexander Mitsos, Artur M. Schweidtmann

Molecular property prediction is of crucial importance in many disciplines such as drug discovery, molecular biology, or material and process design.

Drug Discovery Molecular Property Prediction +1

Modeling Category-Selective Cortical Regions with Topographic Variational Autoencoders

1 code implementation NeurIPS Workshop SVRHM 2021 T. Anderson Keller, Qinghe Gao, Max Welling

Category-selectivity in the brain describes the observation that certain spatially localized areas of the cerebral cortex tend to respond robustly and selectively to stimuli from specific limited categories.

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