Direction of books or issues of journals – books – book chapters

Publications HAL de la structure 395188;421616

2015

Book section

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Clémentine Aguirre, Olivier Cala, Isabelle Krimm. Overview of probing protein-ligand interactions using NMR. Current Protocols in Protein Science, 81, John Wiley & Sons, Ltd, pp.17.18.1-17.18.24, 2015, 9780471140863. <10.1002/0471140864.ps1718s81>. <hal-01187450>
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Isabelle Krimm. Applications of NMR in fragment-based drug design. Howard S. and Abell C. Fragment-based drug discovery, pp.101-125, 2015, 978-1-84973-908-5. <10.1039/9781782620938-00049>. <hal-01234649>
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Articles in peer-review journals

Publications HAL de la structure 395188;421616

2016

Journal articles

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Abdelhakim Ahmed-Belkacem, Lionel Colliandre, Nazim Ahnou, Quentin Nevers, Muriel Gelin, et al.. Fragment-based discovery of a new family of non-peptidic small-molecule cyclophilin inhibitors with potent antiviral activities. Nature Communications, Nature Publishing Group, 2016, 7, pp. Article Number: 12777 <10.1038/ncomms12777>. <hal-01397719>
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2015

Journal articles

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Zsuzsanna Marton, Rémi Guillon, Isabelle Krimm, Rahila Rahimova, David Egron, et al.. Identification of noncompetitive inhibitors of cytosolic 5′-nucleotidase II using a fragment-based approach. Journal of Medicinal Chemistry, American Chemical Society, 2015, 58 (24), pp.9680-9696. <10.1021/acs.jmedchem.5b01616>. <hal-01251800>
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Olivier Cala, Isabelle Krimm. Ligand-orientation based fragment selection in STD NMR screening.. Journal of Medicinal Chemistry, American Chemical Society, 2015, 58 (21), pp.8739-8742. <10.1021/acs.jmedchem.5b01114>. <hal-01234640>
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Jens Pilger, Adam Mazur, Peter Monecke, Herman Schreuder, Bettina Elshorst, et al.. A Combination of Spin Diffusion Methods for the Determination of Protein-Ligand Complex Structural Ensembles. Angewandte Chemie, Wiley-VCH Verlag, 2015, 54 (22), pp.6511-6515. <10.1002/anie.201500671>. <hal-01165216>
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Isabelle Krimm. Fragment-based screening: a promising avenue for drug design. médecine/sciences, EDP Sciences, 2015, 31 (2), pp.197-202. <10.1051/medsci/20153102017>. <hal-01187367>
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Tim Ten Brink, Clémentine Aguirre, Thomas E. Exner, Isabelle Krimm. Performance of Protein–Ligand Docking with Simulated Chemical Shift Perturbations. Journal of Chemical Information and Modeling, American Chemical Society, 2015, 55 (2), pp.275-283. <10.1021/ci500446s>. <hal-01087991>
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2014

Journal articles

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Clémentine Aguirre, Olivier Cala, Tim Ten Brink, Jean François Guichou, Isabelle Krimm. Protein–ligand structure guided by backbone and side-chain proton chemical shift perturbations. Journal of Biomolecular NMR, Springer Verlag, 2014, 60 (2-3), pp.147-156. <10.1007/s10858-014-9864-9>. <hal-01088012>
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Clémentine Aguirre, Tim Ten Brink, Jean François Guichou, Olivier Cala, Isabelle Krimm. Comparing Binding Modes of Analogous Fragments Using NMR in Fragment-Based Drug Design: Application to PRDX5. PLoS ONE, Public Library of Science, 2014, 9 (7), pp.e102300. <10.1371/journal.pone.0102300>. <hal-01067905>
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Olivier Cala, Florence Guillière, Isabelle Krimm. NMR-based analysis of protein-ligand interactions.. Analytical and Bioanalytical Chemistry, Springer Verlag, 2014, 406 (4), pp.943-956. <10.1007/s00216-013-6931-0>. <hal-00956230>
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2013

Journal articles

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Clémentine Aguirre, Tim Ten Brink, Olivier Walker, Florence Guillière, D. Davesne, et al.. BcL-xL Conformational Changes upon Fragment Binding Revealed by NMR. PLoS ONE, Public Library of Science, 2013, 8, pp.e64400. <10.1371/journal.pone.0064400>. <in2p3-00839023>
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2012

Journal articles

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Anja Lange, Mouhamad-Baligh Ismail, Gwladys Rivière, Maggy Hologne, Denis Lacabanne, et al.. Competitive binding of UBPY and ubiquitin to the STAM2 SH3 domain revealed by NMR. FEBS Letters, Wiley, 2012, 586 (19), pp.3379-3384. <10.1016/j.febslet.2012.07.047>. <hal-00819142>
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Isabelle Krimm. INPHARMA-based identification of ligand binding site in fragment-based drug design. MedChemComm, Royal Society of Chemistry, 2012, 3 (5), pp.605-610. <10.1039/c2md20035j>. <hal-00819132>
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Isabelle Krimm, Jean-Marc Lancelin, Jean-Pierre Praly. Binding evaluation of fragment-based scaffolds for probing allosteric enzymes. Journal of Medicinal Chemistry, American Chemical Society, 2012, 55 (3), pp.1287-1295. <http://pubs.acs.org/doi/abs/10.1021/jm201439b>. <10.1021/jm201439b >. <hal-01087963>
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2011

Journal articles

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Sarah Barelier, Isabelle Krimm. Ligand specificity, privileged substructures and protein druggability from fragment-based screening. Current Opinion in Chemical Biology, Elsevier, 2011, 15 (4), pp.469-474. <10.1016/j.cbpa.2011.02.020>. <hal-00819077>
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