The target landscape of clinical kinase drugs S Klaeger, S Heinzlmeir, M Wilhelm, H Polzer, B Vick, PA Koenig, ... Science 358 (6367), eaan4368, 2017 | 785 | 2017 |
Prosit: proteome-wide prediction of peptide tandem mass spectra by deep learning S Gessulat, T Schmidt, DP Zolg, P Samaras, K Schnatbaum, J Zerweck, ... Nature methods 16 (6), 509-518, 2019 | 728 | 2019 |
OpenMS: a flexible open-source software platform for mass spectrometry data analysis HL Röst, T Sachsenberg, S Aiche, C Bielow, H Weisser, F Aicheler, ... Nature methods 13 (9), 741-748, 2016 | 657 | 2016 |
ZIB structure prediction pipeline: composing a complex biological workflow through web services P May, HC Ehrlich, T Steinke Euro-Par 2006 Parallel Processing: 12th International Euro-Par Conference …, 2006 | 440 | 2006 |
Building ProteomeTools based on a complete synthetic human proteome DP Zolg, M Wilhelm, K Schnatbaum, J Zerweck, T Knaute, B Delanghe, ... Nature methods 14 (3), 259-262, 2017 | 242 | 2017 |
ProteomicsDB T Schmidt, P Samaras, M Frejno, S Gessulat, M Barnert, H Kienegger, ... Nucleic acids research 46 (D1), D1271-D1281, 2018 | 227 | 2018 |
ProteomicsDB: a multi-omics and multi-organism resource for life science research P Samaras, T Schmidt, M Frejno, S Gessulat, M Reinecke, A Jarzab, ... Nucleic acids research 48 (D1), D1153-D1163, 2020 | 192 | 2020 |
Torsion angle preferences in druglike chemical space: a comprehensive guide C Scharfer, T Schulz-Gasch, HC Ehrlich, W Guba, M Rarey, M Stahl Journal of Medicinal Chemistry 56 (5), 2016-2028, 2013 | 138 | 2013 |
Maximum common subgraph isomorphism algorithms and their applications in molecular science: a review HC Ehrlich, M Rarey Wiley Interdisciplinary Reviews: Computational Molecular Science 1 (1), 68-79, 2011 | 121 | 2011 |
From structure diagrams to visual chemical patterns K Schomburg, HC Ehrlich, K Stierand, M Rarey Journal of chemical information and modeling 50 (9), 1529-1535, 2010 | 70 | 2010 |
Gustaf: Detecting and correctly classifying SVs in the NGS twilight zone K Trappe, AK Emde, HC Ehrlich, K Reinert Bioinformatics 30 (24), 3484-3490, 2014 | 66 | 2014 |
Systematic benchmark of substructure search in molecular graphs-From Ullmann to VF2 HC Ehrlich, M Rarey Journal of cheminformatics 4, 1-17, 2012 | 54 | 2012 |
Comparing molecular patterns using the example of SMARTS: theory and algorithms R Schmidt, ESR Ehmki, F Ohm, HC Ehrlich, A Mashychev, M Rarey Journal of Chemical Information and Modeling 59 (6), 2560-2571, 2019 | 30 | 2019 |
Searching for recursively defined generic chemical patterns in nonenumerated fragment spaces HC Ehrlich, AM Henzler, M Rarey Journal of chemical information and modeling 53 (7), 1676-1688, 2013 | 14 | 2013 |
ZIB Predicción de una estructura de gasoductos: Redacción de un flujo de trabajo complejo biológico a través de Servicios Web P May, HC Ehrlich, T Steinke Euro-Par, 1148, 2006 | 12 | 2006 |
Searching for substructures in fragment spaces HC Ehrlich, A Volkamer, M Rarey Journal of chemical information and modeling 52 (12), 3181-3189, 2012 | 11 | 2012 |
Zib structure prediction pipeline: composing a complex biological workflow through web services. Euro-Par 2006 Parallel Processing P May, H Ehrlich, T Steinke Springer Berlin/Heidelberg, 2006 | 7 | 2006 |
Chemical pattern visualization in 2D–the SMARTSviewer K Schomburg, HC Ehrlich, K Stierand, M Rarey Journal of Cheminformatics 3, 1-1, 2011 | 6 | 2011 |
Searching substructures in fragment spaces HC Ehrlich, M Rarey Journal of Cheminformatics 3 (Suppl 1), P11, 2011 | 3 | 2011 |
Searching for Generic Chemical Patterns in Combinatorial Chemical Spaces HC Ehrlich Staats-und Universitätsbibliothek Hamburg Carl von Ossietzky, 2013 | 1 | 2013 |