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Robert Schmidt

7PUBLICATIONS

10CO-AUTHORS

Cheminformatics and quantitative structure-activity relationshipsArtificial life and complex adaptive systemsOpen accessProgramming languagesFormal methods for software

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Publications (7)

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|Mar 17, 2024

SpaceGrow: efficient shape-based virtual screening of billion-sized combinatorial fragment spaces.

Sophia M N Hönig, Florian Flachsenberg, Christiane Ehrt

|Mar 23, 2022

The Torsion Library: Semiautomated Improvement of Torsion Rules with SMARTScompare.

Patrick Penner, Wolfgang Guba, Robert Schmidt

|Sep 03, 2021

Maximum Common Substructure Searching in Combinatorial Make-on-Demand Compound Spaces.

Robert Schmidt, Raphael Klein, Matthias Rarey

|Dec 16, 2020

Disconnected Maximum Common Substructures under Constraints.

Robert Schmidt, Florian Krull, Anna Lina Heinzke

|Sep 30, 2020

SMARTS.plus - A Toolbox for Chemical Pattern Design.

Christiane Ehrt, Bennet Krause, Robert Schmidt

|May 25, 2019

Comparing Molecular Patterns Using the Example of SMARTS: Applications and Filter Collection Analysis.

Emanuel S R Ehmki, Robert Schmidt, Farina Ohm

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Frequent Collaborators

7 joint publications

Matthias Rarey

2 joint publications

Emanuel S R Ehmki

2 joint publications

Christiane Ehrt

1 joint publications

Raphael Klein

1 joint publications

Patrick Penner

1 joint publications

Agnes Meyder

1 joint publications

Sophia M N Hönig

1 joint publications

Florian Flachsenberg

1 joint publications

Alexander Neumann

1 joint publications

Christian Lemmen

Frequent Collaborators

7 joint publications

Matthias Rarey

2 joint publications

Emanuel S R Ehmki

2 joint publications

Christiane Ehrt

1 joint publications

Raphael Klein

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