Frank von Delft

University of Oxford

United Kingdom

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Articles (10)

Year:

2023

Year:

2023

Year:

2023

Year:

2023

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2022

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2022

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2022

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2022

Year:

2021

Year:

2021

Collaborators (10)

Roderick Hubbard

Lecturer, Reader (1990), Professor (1995), Emeritus (2020)

University of York

UNITED KINGDOM

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David Mobley

Professor

University of California, Irvine

UNITED STATES

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Andrew Merritt

Head of Chemistry

UNITED KINGDOM

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Charlotte M Deane

University of Oxford

UNITED KINGDOM

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Rolf Backofen

Full Professor

GERMANY

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Christopher G Dowson

University of Warwick

UNITED KINGDOM

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Arthur Van Aerschot

Professor

KU Leuven

BELGIUM

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Tryfon Zarganes - Tzitzikas

University of Oxford

UNITED KINGDOM

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Ruben Sanchez-Garcia

Assistant Professor

IE University

SPAIN

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Björn Grüning

University of Freiburg

GERMANY

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Frank von Delft

Research Interests

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Articles (10)

Fragment Merging Using a Graph Database Samples Different Catalogue Space than Similarity Search

CoPriNet: graph neural networks provide accurate and rapid compound price prediction for molecule prioritisation

A Small Step Toward Generalizability: Training a Machine Learning Scoring Function for Structure-Based Virtual Screening

Discovery and Development Strategies for SARS-CoV-2 NSP3 Macrodomain Inhibitors

Galaxy workflows for fragment-based virtual screening: a case study on the SARS-CoV-2 main protease

SAMPL7 protein-ligand challenge: A community-wide evaluation of computational methods against fragment screening and pose-prediction

Discovery of novel druggable pockets on polyomavirus VP1 through crystallographic fragment-based screening to develop capsid assembly inhibitors

Fragment Libraries Designed to Be Functionally Diverse Recover Protein Binding Information More Efficiently Than Standard Structurally Diverse Libraries

High-Throughput Crystallography Reveals Boron-Containing Inhibitors of a Penicillin-Binding Protein with Di- and Tricovalent Binding Modes.

There is no market for new antibiotics: this allows an open approach to research and development

Collaborators (10)

Roderick Hubbard

David Mobley

Andrew Merritt

Charlotte M Deane

Rolf Backofen

Christopher G Dowson

Arthur Van Aerschot

Tryfon Zarganes - Tzitzikas

Ruben Sanchez-Garcia

Björn Grüning

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