Pascal Friederich

31PUBLICATIONS
117CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsNanoscale characterisationComputational chemistryComposite and hybrid materialsGraph, social and multimedia data
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Publications (31)

|Jun 22, 2026
Mapping the Molecular Universe: Exploring Chemical Compound Space by Multiscale High-Throughput Screening and Machine Learning.

|Jun 11, 2026
Ultra-High-Throughput Discovery of Multifunctional Polyphenolic Coatings on Droplet Microarrays.

|Apr 09, 2026
Learning potential energy surfaces of hydrogen atom transfer reactions in peptides.

Marlen Neubert, Patrick Reiser, Frauke Gräter

|Feb 26, 2026
Generative Models for Crystalline Materials.

Houssam Metni, Laura Ruple, Lauren N Walters

|Oct 01, 2025
The Black Hole Strategy: Gravity-Based Representative Sampling for Frugal Graph Learning on Metal-Organic Framework Networks.

Mehrdad Jalali, A D Dinga Wonanke, Pascal Friederich

|Aug 10, 2025
Advancing Aqueous Solubility Prediction: A Machine Learning Approach for Organic Compounds Using a Curated Data Set.

Mushtaq Ali, Sylvia Vanderheiden, Christoph W Grathwol

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Frequent Collaborators

7 joint publications

Patrick Reiser

5 joint publications

Alán Aspuru-Guzik

3 joint publications

Wolfgang Wenzel

3 joint publications

Luca Torresi