| PubChem chemical structure standardization VD Hähnke, S Kim, EE Bolton Journal of cheminformatics 10, 1-40, 2018 | 133 | 2018 |
| SmiLib v2. 0: A Java‐Based Tool for Rapid Combinatorial Library Enumeration A Schüller, V Hähnke, G Schneider QSAR & Combinatorial Science 26 (3), 407-410, 2007 | 77 | 2007 |
| Reaction-driven de novo design, synthesis and testing of potential type II kinase inhibitors G Schneider, T Geppert, M Hartenfeller, F Reisen, A Klenner, ... Future Medicinal Chemistry 3 (4), 415-424, 2011 | 50 | 2011 |
| PhAST: pharmacophore alignment search tool V Hähnke, B Hofmann, T Grgat, E Proschak, D Steinhilber, G Schneider Journal of Computational Chemistry 30 (5), 761-771, 2009 | 29 | 2009 |
| PubChem structure–activity relationship (SAR) clusters S Kim, L Han, B Yu, VD Hähnke, EE Bolton, SH Bryant Journal of Cheminformatics 7 (Article 33), 1-22, 2015 | 26 | 2015 |
| Virtual screening for compounds that mimic protein–protein interface epitopes T Geppert, F Reisen, M Pillong, V Hähnke, Y Tanrikulu, CP Koch, ... Journal of Computational Chemistry 33 (5), 573-579, 2012 | 18 | 2012 |
| PubChem atom environments VD Hähnke, EE Bolton, SH Byant Journal of Cheminformatics 7 (Article 41), 1-37, 2015 | 14 | 2015 |
| SEARCHFORMER: Semantic patent embeddings by siamese transformers for prior art search K Vowinckel, VD Hähnke World Patent Information 73, 102192, 2023 | 13 | 2023 |
| Pharmacophore alignment search tool: Influence of canonical atom labeling on similarity searching V Hähnke, M Rupp, M Krier, F Rippmann, G Schneider Journal of Computational Chemistry 31 (15), 2810-2826, 2010 | 13 | 2010 |
| From Virtual Screening to Bioactive Compounds by Visualizing and Clustering of Chemical Space A Klenner, V Hähnke, T Geppert, P Schneider, H Zettl, S Haller, ... Molecular Informatics 31 (1), 21-26, 2012 | 12 | 2012 |
| Multistep Virtual Screening for Rapid and Efficient Identification of Non‐Nucleoside Bacterial Thymidine Kinase Inhibitors J Zander, M Hartenfeller, V Hähnke, E Proschak, S Besier, TA Wichelhaus, ... Chemistry-A European Journal 16 (31), 9630-9637, 2010 | 12 | 2010 |
| PubChem chemical structure standardization. J Cheminform 10: 36 VD Hähnke, S Kim, EE Bolton | 7 | 2018 |
| Pharmacophore alignment search tool: Influence of scoring systems on text‐based similarity searching V Hähnke, G Schneider Journal of Computational Chemistry 32 (8), 1635-1647, 2011 | 7 | 2011 |
| Discovery of γ-secretase modulators with a novel activity profile by text-based virtual screening H Zettl, J Ness, V Hähnke, D Beher, T Jumpertz, A Saric, K Baumann, ... ACS chemical biology 7 (9), 1488-1495, 2012 | 6 | 2012 |
| Significance estimation for sequence-based chemical similarity searching (PhAST) and application to AuroraA kinase inhibitors V Hähnke, N Todoroff, T Rodrigues, G Schneider Future Medicinal Chemistry 4 (15), 1897-1906, 2012 | 5 | 2012 |
| Pharmacophore Alignment Search Tool (PhAST): Significance Assessment of Chemical Similarity V Hähnke, M Rupp, AK Hartmann, G Schneider Molecular Informatics 32 (7), 625-646, 2013 | 3 | 2013 |
| Building Machine Translation Tools for Patent Language: A Data Generation Strategy at the European Patent Office M Wirth, VD Hähnke, F Mascia, A Wéry, K Vowinckel, M del Rey, ... Proceedings of the 24th Annual Conference of the European Association for …, 2023 | 2 | 2023 |
| Pharmacophore alignment search tool: Influence of the third dimension on text‐based similarity searching V Hähnke, A Klenner, F Rippmann, G Schneider Journal of Computational Chemistry 32 (8), 1618-1634, 2011 | 2 | 2011 |
| PubChem: atom environments for molecule standardization V Hähnke, EE Bolton, SH Bryant Journal of Cheminformatics 5 (Suppl 1), P38, 2013 | 1 | 2013 |
| Text-based similarity searching for hit- and lead-candidate identification V Hähnke Journal of Cheminformatics 4 (Suppl 1), O12, 2012 | | 2012 |
Sunghwan KimStaff Scientist, National Institutes of HealthVerified email at ncbi.nlm.nih.gov
