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Simulation Model Exchange in Process Industry: Requirements, Solutions, and Open Challenges2025 Chemical Engineering & Technology article Computer Science Modeling and Simulation Systems Open access
Jonathan Mädler, Claudia Guadarrama Serrano, Isabell Viedt, Tamás Farkas, Wilhelm Otten, Stefan Krämer, +1 more
2citations -
Simulation Model Exchange in Process Industry: Requirements, Solutions, and Open Challenges2025 Chemical Engineering & Technology article Computer Science Modeling and Simulation Systems Open access
Jonathan Mädler, Claudia Guadarrama Serrano, Isabell Viedt, Tamás Farkas, Julia Semrau, Wilhelm Otten, +1 more
0citations -
Schnell zu neuen Materialien – Effizientes Forschungsdatenmanagement an der Aachener Verfahrenstechnik2020 Chemie Ingenieur Technik article Computer Science Research Data Management Practices Open access
Hannah Roth, Daniel Menne, Johannes Kamp, Stephan Emonds, H. Wollf, Matthias Weßling
1citations -
ZZS similarity tool: The online tool for similarity screening to identify chemicals of potential concern2022 Journal of Computational Chemistry article Computer Science Computational Drug Discovery Methods Open access
Pim N.H. Wassenaar, Emiel Rorije, Martina G. Vijver, Willie J.G.M. Peijnenburg
12citations -
In Search of Beautiful Molecules: A Perspective on Generative Modeling for Drug Design2025 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Remco L. van den Broek, Shivam Patel, Gerard J. P. van Westen, Willem Jespers, Woody Sherman
37citations -
Doing More with Less: Accurate and Scalable Ligand Free Energy Calculations by Focusing on the Binding Site2026 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
David Alencar Araripe, Alejandro Díaz‐Holguín, Antti Poso, Gerard J. P. van Westen, Johan Åqvist, Hugo Gutiérrez‐de‐Terán, +1 more
3citations -
eCherry: A Modelica Library for Modular Dynamic Modelling of Electrochemical Reactors2025 Electrochemical Science Advances article Computer Science Modeling and Simulation Systems Open access
Jan F. Pyschik, Katharina M. Ebeling, Georgia Ioanna Prokopou, Michael J. Rix, J. Raphael Seidenberg, Matthias Leitl, +2 more
2citations
10 results