| A small-molecule inhibitor of Lin28 M Roos, U Pradère, RP Ngondo, A Behera, S Allegrini, G Civenni, ... ACS chemical biology 11 (10), 2773-2781, 2016 | 152 | 2016 |
| Binding mode of acetylated histones to bromodomains: variations on a common motif JR Marchand, A Caflisch ChemMedChem 10 (8), 1327-1333, 2015 | 34 | 2015 |
| Discovery of inhibitors of four bromodomains by fragment-anchored ligand docking JR Marchand, A Dalle Vedove, G Lolli, A Caflisch Journal of chemical information and modeling 57 (10), 2584-2597, 2017 | 26 | 2017 |
| Derivatives of 3-amino-2-methylpyridine as BAZ2B bromodomain ligands: in silico discovery and in crystallo validation JR Marchand, G Lolli, A Caflisch Journal of Medicinal Chemistry 59 (21), 9919-9927, 2016 | 24 | 2016 |
| Virtual screen to NMR (VS2NMR): Discovery of fragment hits for the CBP bromodomain D Spiliotopoulos, J Zhu, EC Wamhoff, N Deerain, JR Marchand, J Aretz, ... Bioorganic & medicinal chemistry letters 27 (11), 2472-2478, 2017 | 22 | 2017 |
| In silico fragment-based drug design with SEED JR Marchand, A Caflisch European journal of medicinal chemistry 156, 907-917, 2018 | 21 | 2018 |
| Investigating the allosteric reverse signalling of PARP inhibitors with microsecond molecular dynamic simulations and fluorescence anisotropy JR Marchand, A Carotti, D Passeri, P Filipponi, P Liscio, E Camaioni, ... Biochimica et Biophysica Acta (BBA)-Proteins and Proteomics 1844 (10), 1765-1772, 2014 | 19 | 2014 |
| Structural analysis of small‐molecule binding to the BAZ2A and BAZ2B Bromodomains A Dalle Vedove, D Spiliotopoulos, VG D'Agostino, JR Marchand, A Unzue, ... ChemMedChem 13 (14), 1479-1487, 2018 | 14 | 2018 |
| CAVIAR: a method for automatic cavity detection, description and decomposition into subcavities JR Marchand, B Pirard, P Ertl, F Sirockin Journal of Computer-Aided Molecular Design 35 (6), 737-750, 2021 | 13 | 2021 |
| An ABSINTH-based protocol for predicting binding affinities between proteins and small molecules JR Marchand, T Knehans, A Caflisch, A Vitalis Journal of chemical information and modeling 60 (10), 5188-5202, 2020 | 5 | 2020 |
| Identification of a BAZ2A-bromodomain hit compound by fragment growing A Dalle Vedove, G Cazzanelli, L Batiste, JR Marchand, D Spiliotopoulos, ... ACS Medicinal Chemistry Letters 13 (9), 1434-1443, 2022 | 2 | 2022 |
| Identification of BAZ2A bromodomain hit compounds A Dalle Vedove, G Cazzanelli, J Corsi, M Sedykh, L Batiste, JR Marchand, ... Acta Crystallographica Section A: Foundations and Advances 78, a418-a418, 2022 | | 2022 |
| Automatic cavity identification and decomposition into subpockets with CAVIAR JR Marchand, B Pirard, P Ertl, F Sirockin | | 2020 |
| Computational Drug Discovery: Methods Development and Applications to Bromodomains JR Marchand University of Zurich, 2017 | | 2017 |
| 1μs Molecular Dynamics Simulations to study the poisoning effect of the PARP-1 full length enzyme JR Marchand, A Carotti, E Camaioni, R Pellicciari, A Macchiarulo BOOK OF ABSTRACTs Computationally Driven Drug Discovery Meeting CDDD 2014, 2014 | | 2014 |
| Insights in the PARP1 poisoning effect JR Marchand, A Carotti, E Camaioni, R Pellicciari, A Macchiarulo BOOK OF ABSTRACTS High-Throughput Molecular Dynamics Workshop, 2013 | | 2013 |
Amedeo CaflischDepartment of Biochemistry, University of ZurichVerified email at bioc.uzh.ch
