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Medientyp
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- Rarey, Matthias
- Volkamer, Andrea 10
- Ehrt, Christiane 9
- Flachsenberg, Florian 9
- Bietz, Stefan 8
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189 Einträge gefunden
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Optimization and Evaluation Datasets for PiMine
2024 - Forschungsdatenrepositorium der UHH - frei zugänglich -
Redocking the PDB
2024 - Forschungsinformationssystem der UHH -
Optimization and Evaluation Datasets for PiMine
2024 - Forschungsdatenrepositorium der UHH - frei zugänglich -
School of cheminformatics in Latin America
- Gonzalez-Ponce, Karla
- Horta Andrade, Carolina
- Hunter, Fiona
- Kirchmair, Johannes
- Martinez-Mayorga, Karina
- Medina-Franco, José L.
- Rarey, Matthias
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LifeSoaks:A tool for analyzing solvent channels in protein crystals and obstacles for soaking experiments
- Pletzer-Zelgert, Jonathan
- Ehrt, Christiane
- Fender, Inken
- Griewel, Axel
- Flachsenberg, Florian
- Klebe, Gerhard
- Rarey, Matthias
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Modeling with Alternate Locations in X-ray Protein Structures
2023 - Forschungsinformationssystem der UHH -
PoseEdit:enhanced ligand binding mode communication by interactive 2D diagrams
2023 - Forschungsinformationssystem der UHH - frei zugänglich -
Optimization and Evaluation Datasets for PiMine
2023 - Forschungsdatenrepositorium der UHH - frei zugänglich -
Full Modification Control over Retrosynthetic Routes for Guided Optimization of Lead Structures
2023 - Forschungsinformationssystem der UHH -
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The Torsion Library: Semiautomated Improvement of Torsion Rules with SMARTScompare
2022 - Forschungsinformationssystem der UHH -
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Galileo: Three-dimensional searching in large combinatorial fragment spaces on the example of pharmacophores
2022 - Forschungsinformationssystem der UHH - frei zugänglich -
Comparison of Combinatorial Fragment Spaces and Its Application to Ultralarge Make-on-Demand Compound Catalogs
2022 - Forschungsinformationssystem der UHH -
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Small molecule superposition: A comprehensive overview on pose scoring of the latest methods
2022 - Forschungsinformationssystem der UHH - frei zugänglich -
FastGrow: on-the-fly growing and its application to DYRK1A
- Penner, Patrick
- Martiny, Virginie
- Bellmann, Louis
- Flachsenberg, Florian
- Gastreich, Marcus
- Theret, Isabelle
- Meyer, Christophe
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ProteinsPlus: a comprehensive collection of web-based molecular modeling tools
- Schöning-Stierand, Katrin
- Diedrich, Konrad
- Ehrt, Christiane
- Flachsenberg, Florian
- Graef, Joel
- Sieg, Jochen
- Penner, Patrick