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)

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|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

Patrick Reiser

Alán Aspuru-Guzik

Wolfgang Wenzel

Luca Torresi

Juan S Rocha-Ortiz

Houssam Metni

Frauke Gräter

Jens Hauch

Marlen Neubert

Robert Pollice

Frequent Collaborators

Patrick Reiser

Alán Aspuru-Guzik

Wolfgang Wenzel

Luca Torresi