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Lisa Sach-Peltason
Lisa Sach-Peltason
F. Hoffmann-La Roche
Verified email at roche.com
Title
Cited by
Cited by
Year
Quo vadis, virtual screening? A comprehensive survey of prospective applications
P Ripphausen, B Nisius, L Peltason, J Bajorath
Journal of medicinal chemistry 53 (24), 8461-8467, 2010
2772010
SAR index: Quantifying the nature of structure− activity relationships
L Peltason, J Bajorath
Journal of medicinal chemistry 50 (23), 5571-5578, 2007
1882007
Navigating structure–activity landscapes
J Bajorath, L Peltason, M Wawer, R Guha, MS Lajiness, JH Van Drie
Drug discovery today 14 (13-14), 698-705, 2009
1792009
Structure− activity relationship anatomy by network-like similarity graphs and local structure− activity relationship indices
M Wawer, L Peltason, N Weskamp, A Teckentrup, J Bajorath
Journal of medicinal chemistry 51 (19), 6075-6084, 2008
1522008
Rationalizing three-dimensional activity landscapes and the influence of molecular representations on landscape topology and the formation of activity cliffs
L Peltason, P Iyer, J Bajorath
Journal of chemical information and modeling 50 (6), 1021-1033, 2010
922010
Molecular similarity analysis uncovers heterogeneous structure-activity relationships and variable activity landscapes
L Peltason, J Bajorath
Chemistry & biology 14 (5), 489-497, 2007
692007
From structure–activity to structure–selectivity relationships: quantitative assessment, selectivity cliffs, and key compounds
L Peltason, Y Hu, J Bajorath
ChemMedChem: Chemistry Enabling Drug Discovery 4 (11), 1864-1873, 2009
592009
Systematic computational analysis of structure–activity relationships: concepts, challenges and recent advances
L Peltason, J Bajorath
Future Medicinal Chemistry 1 (3), 451-466, 2009
502009
Structural interpretation of activity cliffs revealed by systematic analysis of structure− activity relationships in analog series
MT Sisay, L Peltason, J Bajorath
Journal of chemical information and modeling 49 (10), 2179-2189, 2009
422009
Exploration of Structure− Activity Relationship Determinants in Analogue Series
L Peltason, N Weskamp, A Teckentrup, J Bajorath
Journal of medicinal chemistry 52 (10), 3212-3224, 2009
362009
Elucidation of structure− activity relationship pathways in biological screening data
M Wawer, L Peltason, J Bajorath
Journal of medicinal chemistry 52 (4), 1075-1080, 2009
322009
Computational Analysis of Multi‐target Structure–Activity Relationships to Derive Preference Orders for Chemical Modifications toward Target Selectivity
AM Wassermann, L Peltason, J Bajorath
ChemMedChem: Chemistry Enabling Drug Discovery 5 (6), 847-858, 2010
282010
Inducers of the endothelial cell barrier identified through chemogenomic screening in genome-edited hPSC-endothelial cells
F Roudnicky, JD Zhang, BK Kim, NJ Pandya, Y Lan, L Sach-Peltason, ...
Proceedings of the National Academy of Sciences 117 (33), 19854-19865, 2020
252020
Molecular similarity analysis in virtual screening
L Peltason, J Bajorath
Chemoinformatics Approaches to Virtual Screening, 120-149, 2008
162008
Multiscale modelling of drug mechanism and safety
JD Zhang, L Sach-Peltason, C Kramer, K Wang, M Ebeling
Drug Discovery Today 25 (3), 519-534, 2020
112020
Blocked inverted indices for exact clustering of large chemical spaces
P Thiel, L Sach-Peltason, C Ottmann, O Kohlbacher
Journal of Chemical Information and Modeling 54 (9), 2395-2401, 2014
112014
Computational analysis of activity and selectivity cliffs
L Peltason, J Bajorath
Chemoinformatics and Computational Chemical Biology, 119-132, 2011
92011
Refinement of a model of repeated cerebrospinal fluid collection in conscious rats
EM Amen, M Brecheisen, L Sach-Peltason, A Bergadano
Laboratory animals 51 (1), 44-53, 2017
62017
Clinical characterization of epilepsy in children with Angelman syndrome
D Cassater, M Bustamante, L Sach-Peltason, A Rotenberg, M Nespeca, ...
Pediatric Neurology 124, 42-50, 2021
32021
SAR Analyzer: a tool for interactive SAR data visualization and navigation
L Peltason, D Stoffler
Journal of Cheminformatics 4 (1), 1-1, 2012
12012
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Articles 1–20