PDFs anfordern:
Um eine PDF-Kopie einer Publikation anzufordern, markieren Sie bitte die entsprechende Publikation durch Klick auf den PDF-Button. Mehrere Auswahlen sind möglich. Geben Sie dann bitte am Ende der Seite Ihre eMailadresse an und klicken auf "PDF's anfordern".
| Manuscript type (click on type for subselection) | No. | Publikationen | Jahr | Link |
|---|---|---|---|---|
| type | No. | Publikationen | Jahr | Link |
| Journal Article | 467 | Sommer, K.; Friedrich, N.-O.; Bietz, S.; Hilbig, M.; Inhester, T.; Rarey, M: UNICON: A powerful and easy-to-use compound library converter Journal of Chemical Information and Modeling, 56(6): 1105–1111. |
2016 | Sommer, K.; Friedrich, N.-O.; Bietz, S.; Hilbig, M.; Inhester, T.; Rarey, M: (2016) UNICON: A powerful and easy-to-use compound library converter . Journal of Chemical Information and Modeling, 56(6):1105–1111. |
| Journal Article | 483 | Friedrich, N.-O.; Meyder, A.; Sommer, K.; Flachsenberg, F.; de Bruyn Kops, C.; Rarey, M.; Kirchmair, J. High-quality dataset of protein-bound ligand conformations and its application to benchmarking conformer ensemble generators Journal of Chemical Information and Modeling, 57(3): 529-539. |
2017 | Friedrich, N.-O.; Meyder, A.; Sommer, K.; Flachsenberg, F.; de Bruyn Kops, C.; Rarey, M.; Kirchmair, J. (2017) High-quality dataset of protein-bound ligand conformations and its application to benchmarking conformer ensemble generators . Journal of Chemical Information and Modeling, 57(3):529-539. |
| Journal Article | 491 | de Bruyn Kops, Ch.; Friedrich, N.-O.; Kirchmair, J. Alignment-Based Prediction of Sites of Metabolism Journal of Chemical Information and Modeling, 57(6): 1258-1264. |
2017 | de Bruyn Kops, Ch.; Friedrich, N.-O.; Kirchmair, J. (2017) Alignment-Based Prediction of Sites of Metabolism . Journal of Chemical Information and Modeling, 57(6):1258-1264. |
| Journal Article | 499 | Friedrich, N.-O.; de Bruyn Kops, Christina; Flachsenberg, F.; Sommer, K.; Rarey, M.; Kirchmair, J. Benchmarking Commercial Conformer Ensemble Generators Journal of Chemical Information and Modeling, 57(11): 2719-2728. |
2017 | Friedrich, N.-O.; de Bruyn Kops, Christina; Flachsenberg, F.; Sommer, K.; Rarey, M.; Kirchmair, J. (2017) Benchmarking Commercial Conformer Ensemble Generators . Journal of Chemical Information and Modeling, 57(11):2719-2728. |
| Journal Article | 502 | Stork, C.; Wagner, J.; Friedrich, N.-O.; de Bruyn Kops, C.; Sicho, M.; Kirchmair, J. Hit Dexter: A Machine-Learning Model for the Prediction of Frequent Hitters ChemMedChem: in press. |
2018 | Stork, C.; Wagner, J.; Friedrich, N.-O.; de Bruyn Kops, C.; Sicho, M.; Kirchmair, J. (2018) Hit Dexter: A Machine-Learning Model for the Prediction of Frequent Hitters . ChemMedChem:in press. |
| Journal Article | 515 | Chen, Y.; Garcia de Lomana, M.; Friedrich, N.-O.; Kirchmair, J. Characterization of the Chemical Space of Known and Readily Obtainable Natural Products Journal of Chemical Information and Modeling |
2018 | Chen, Y.; Garcia de Lomana, M.; Friedrich, N.-O.; Kirchmair, J. (2018) Characterization of the Chemical Space of Known and Readily Obtainable Natural Products . Journal of Chemical Information and Modeling |
| Journal Article | 518 | Meyder, A.; Kampen, S.; Sieg, J.; Fährrolfes, R.; Friedrich, N.-O.; Flachsenberg, F.; Rarey, M. StructureProfiler: An all-in-one Tool for 3D Protein Structure Profiling Bioinformatics, 35(5): 874-876. |
2018 | Meyder, A.; Kampen, S.; Sieg, J.; Fährrolfes, R.; Friedrich, N.-O.; Flachsenberg, F.; Rarey, M. (2018) StructureProfiler: An all-in-one Tool for 3D Protein Structure Profiling . Bioinformatics, 35(5):874-876. |
| Journal Article | 531 | Friedrich, N.-O.; Flachsenberg, F.; Meyder, A.; Sommer, K.; Kirchmair, J.; Rarey, M. Conformator: A Novel Method for the Generation of Conformer Ensembles Journal of Chemical Information and Modeling, 59(2): 731-742. |
2019 | Friedrich, N.-O.; Flachsenberg, F.; Meyder, A.; Sommer, K.; Kirchmair, J.; Rarey, M. (2019) Conformator: A Novel Method for the Generation of Conformer Ensembles . Journal of Chemical Information and Modeling, 59(2):731-742. |
Files successfully requested
Ihre Anfrage wird bearbeitet. Bitte prüfen Sie Ihre Mailbox.