Christiane Ehrt

ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 32

Top Venues

Journal of chemical information and modeling

Journal of computer-aided molecular design

Journal of medicinal chemistry

Archiv der Pharmazie

Universität Hamburg

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Universität Hamburg Mar 16 2020

Germany

Research Scientist :: ZBH

Publications

Konrad Diedrich, Christiane Ehrt, Joel Graef, Martin Poppinga, Norbert Ritter, Matthias Rarey
User-centric design of a 3D search interface for protein-ligand complexes. Journal of computer-aided molecular design 38 (1) (2024)
Joel Graef, Christiane Ehrt, Thorben Reim, Matthias Rarey
Database-Driven Identification of Structurally Similar Protein-Protein Interfaces. Journal of chemical information and modeling 64 (8) (2024)
Joel Graef, Christiane Ehrt, Thorben Reim, Matthias Rarey
Database-Driven Identification of Structurally Similar Protein-Protein Interfaces. Journal of chemical information and modeling 64 (8) (2024)
Thorben Reim, Christiane Ehrt, Joel Graef, Sebastian Günther, Alke Meents, Matthias Rarey
SiteMine: Large-scale binding site similarity searching in protein structure databases. Archiv der Pharmazie 357 (5) (2024)
Joel Graef, Christiane Ehrt, Thorben Reim, Matthias Rarey
Database-Driven Identification of Structurally Similar Protein-Protein Interfaces. Journal of chemical information and modeling 64 (8) (2024)
Sophia M N Hönig, Florian Flachsenberg, Christiane Ehrt, Alexander Neumann, Robert Schmidt, Christian Lemmen, Matthias Rarey
SpaceGrow: efficient shape-based virtual screening of billion-sized combinatorial fragment spaces. Journal of computer-aided molecular design 38 (1) (2024)
Konrad Diedrich, Christiane Ehrt, Joel Graef, Martin Poppinga, Norbert Ritter, Matthias Rarey
User-centric design of a 3D search interface for protein-ligand complexes. Journal of computer-aided molecular design 38 (1) (2024)
Joel Graef, Christiane Ehrt, Thorben Reim, Matthias Rarey
Database-Driven Identification of Structurally Similar Protein-Protein Interfaces. Journal of chemical information and modeling (2024)
Joel Graef, Christiane Ehrt, Thorben Reim, Matthias Rarey
Database-Driven Identification of Structurally Similar Protein-Protein Interfaces. Journal of chemical information and modeling 64 (8) (2024)
Konrad Diedrich, Christiane Ehrt, Joel Graef, Martin Poppinga, Norbert Ritter, Matthias Rarey
User-centric design of a 3D search interface for protein-ligand complexes. Journal of computer-aided molecular design 38 (1) (2024)
Sophia M N Hönig, Florian Flachsenberg, Christiane Ehrt, Alexander Neumann, Robert Schmidt, Christian Lemmen, Matthias Rarey
SpaceGrow: efficient shape-based virtual screening of billion-sized combinatorial fragment spaces. Journal of computer-aided molecular design 38 (1) (2024)
Sophia M N Hönig, Florian Flachsenberg, Christiane Ehrt, Alexander Neumann, Robert Schmidt, Christian Lemmen, Matthias Rarey
SpaceGrow: efficient shape-based virtual screening of billion-sized combinatorial fragment spaces. Journal of computer-aided molecular design 38 (1) (2024)
Joel Graef, Christiane Ehrt, Thorben Reim, Matthias Rarey
Database-Driven Identification of Structurally Similar Protein-Protein Interfaces. Journal of chemical information and modeling 64 (8) (2024)
Thorben Reim, Christiane Ehrt, Joel Graef, Sebastian Günther, Alke Meents, Matthias Rarey
SiteMine: Large-scale binding site similarity searching in protein structure databases. Archiv der Pharmazie (2024)
Joel Graef, Christiane Ehrt, Matthias Rarey
Binding Site Detection Remastered: Enabling Fast, Robust, and Reliable Binding Site Detection and Descriptor Calculation with DoGSite3. Journal of chemical information and modeling 63 (10) (2023)
Joel Graef, Christiane Ehrt, Matthias Rarey
Binding Site Detection Remastered: Enabling Fast, Robust, and Reliable Binding Site Detection and Descriptor Calculation with DoGSite3. Journal of chemical information and modeling 63 (10) (2023)
Jonathan Pletzer-Zelgert, Christiane Ehrt, Inken Fender, Axel Griewel, Florian Flachsenberg, Gerhard Klebe, Matthias Rarey
LifeSoaks: a tool for analyzing solvent channels in protein crystals and obstacles for soaking experiments. Acta crystallographica. Section D, Structural biology (2023)
Florian Flachsenberg, Christiane Ehrt, Torben Gutermuth, Matthias Rarey
Redocking the PDB. Journal of chemical information and modeling 64 (1) (2023)
Mike Bührmann, Shivakrishna Kallepu, Jonas D Warmuth, Jan N Wiese, Christiane Ehrt, Helge Vatheuer, Wolf Hiller, Carina Seitz, Laura Levy, Paul Czodrowski, Sonja Sievers, Matthias Philipp Müller, Daniel Rauh
Fragtory: Pharmacophore-Focused Design, Synthesis, and Evaluation of an sp 3 -Enriched Fragment Library. Journal of medicinal chemistry 66 (9) (2023)
Mike Bührmann, Shivakrishna Kallepu, Jonas D Warmuth, Jan N Wiese, Christiane Ehrt, Helge Vatheuer, Wolf Hiller, Carina Seitz, Laura Levy, Paul Czodrowski, Sonja Sievers, Matthias Philipp Müller, Daniel Rauh
Fragtory: Pharmacophore-Focused Design, Synthesis, and Evaluation of an sp 3 -Enriched Fragment Library. Journal of medicinal chemistry (2023)
Joel Graef, Christiane Ehrt, Matthias Rarey
Binding Site Detection Remastered: Enabling Fast, Robust, and Reliable Binding Site Detection and Descriptor Calculation with DoGSite3. Journal of chemical information and modeling (2023)
Florian Flachsenberg, Christiane Ehrt, Torben Gutermuth, Matthias Rarey
Redocking the PDB. Journal of chemical information and modeling 64 (1) (2023)
Florian Flachsenberg, Christiane Ehrt, Torben Gutermuth, Matthias Rarey
Redocking the PDB. Journal of chemical information and modeling 64 (1) (2023)
Mike Bührmann, Shivakrishna Kallepu, Jonas D Warmuth, Jan N Wiese, Christiane Ehrt, Helge Vatheuer, Wolf Hiller, Carina Seitz, Laura Levy, Paul Czodrowski, Sonja Sievers, Matthias Philipp Müller, Daniel Rauh
Fragtory: Pharmacophore-Focused Design, Synthesis, and Evaluation of an sp 3 -Enriched Fragment Library. Journal of medicinal chemistry 66 (9) (2023)
Florian Flachsenberg, Christiane Ehrt, Torben Gutermuth, Matthias Rarey
Redocking the PDB. Journal of chemical information and modeling (2023)
Katrin Schöning-Stierand, Konrad Diedrich, Christiane Ehrt, Florian Flachsenberg, Joel Graef, Jochen Sieg, Patrick Penner, Martin Poppinga, Annett Ungethüm, Matthias Rarey
ProteinsPlus: a comprehensive collection of web-based molecular modeling tools. Nucleic acids research (2022)
Joel Graef, Christiane Ehrt, Konrad Diedrich, Martin Poppinga, Norbert Ritter, Matthias Rarey
Searching Geometric Patterns in Protein Binding Sites and Their Application to Data Mining in Protein Kinase Structures. Journal of medicinal chemistry (2021)
Sebastian Günther, Patrick Y A Reinke, Yaiza Fernández-García, Julia Lieske, Thomas J Lane, Helen Mary Ginn, Faisal H M Koua, Christiane Ehrt, Wiebke Ewert, Dominik Oberthür, Oleksandr Yefanov, Susanne Meier, Kristina Lorenzen, Boris Krichel, Janine-Denise Kopicki, Luca Gelisio, Wolfgang Brehm, Ilona Dunkel, Brandon Seychell, Henry Gieseler, Brenna Norton-Baker, Beatriz Escudero-Pérez, Martin Domaracky, Sofiane Saouane, Alexandra Tolstikova, Thomas A White, Anna Hänle, Michael Groessler, Holger Fleckenstein, Fabian Trost, Marina Galchenkova, Yaroslav Gevorkov, Chufeng Li, Salah Awel, Ariana Peck, Miriam Barthelmess, Frank Schlünzen, Paul Lourdu Xavier, Nadine Werner, Hina Andaleeb, Najeeb Ullah, Sven Falke, Vasundara Srinivasan, Bruno Alves França, Martin Schwinzer, Hévila Brognaro, Cromarte Rogers, Diogo Melo, Joanna J Zaitseva-Doyle, Juraj Knoška, Gisel Esperanza Pena Murillo, Aida Rahmani Mashhour, Vincent Hennicke, Pontus Fischer, Johanna Hakanpää, Jan Meyer, Philip Gribbon, Bernhard Ellinger, Maria Kuzikov, Markus Wolf, Andrea Rosario Beccari, Gleb Bourenkov, David von Stetten, Guillaume Pompidor, Isabel Bento, Saravanan Panneerselvam, Ivars Karpics, Thomas R Schneider, Maria Marta Garcia-Alai, Stephan Niebling, Christian Günther, Christina Schmidt, Robin Schubert, Huijong Han, Juliane Boger, Diana C F Monteiro, Linlin Zhang, Xinyuanyuan Sun, Jonathan Pletzer-Zelgert, Jan Wollenhaupt, Christian G Feiler, Manfred S Weiss, Eike-Christian Schulz, Pedram Mehrabi, Katarina Karničar, Aleksandra Usenik, Jure Loboda, Henning Tidow, Ashwin Chari, Rolf Hilgenfeld, Charlotte Uetrecht, Russell J Cox, Andrea Zaliani, Tobias Beck, Matthias Rarey, Stephan Gunther, Dusan Turk, Winfried Hinrichs, Henry N Chapman, Arwen R Pearson, Christian Betzel, Alke Meents
X-ray screening identifies active site and allosteric inhibitors of SARS-CoV-2 main protease. Science (New York, N.Y.) 372 (6542) (2021)
Christiane Ehrt, Bennet Krause, Robert Schmidt, Emanuel S R Ehmki, Matthias Rarey
SMARTS.plus - A Toolbox for Chemical Pattern Design. Molecular informatics 39 (12) (2020)
Rosario Oliva, Sudeshna Banerjee, Hasan Cinar, Christiane Ehrt, Roland Hermann Alfons Winter
Alteration of Protein Binding Affinities by Aqueous Two-Phase Systems Revealed by Pressure Perturbation. Scientific reports 10 (1) (2020)
Christiane Ehrt, Tobias Brinkjost, Oliver Koch
Binding site characterization - similarity, promiscuity, and druggability. MedChemComm 10 (7) (2019)
Christiane Ehrt, Tobias Brinkjost, Oliver Koch
A benchmark driven guide to binding site comparison: An exhaustive evaluation using tailor-made data sets (ProSPECCTs). PLoS computational biology 14 (11) (2018)

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Publication Activity (10 Years)

Top Topics

Top Venues

Christiane Ehrt