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Anders Hogner
Anders Hogner
Director Computational Chemistry, Research and Early Development, Cardiovascular, Renal and
Dirección de correo verificada de astrazeneca.com
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Oxadiazoles in medicinal chemistry
J Boström, A Hogner, A Llinàs, E Wellner, AT Plowright
Journal of medicinal chemistry 55 (5), 1817-1830, 2012
6422012
Do structurally similar ligands bind in a similar fashion?
J Boström, A Hogner, S Schmitt
Journal of medicinal chemistry 49 (23), 6716-6725, 2006
2102006
Structural basis for AMPA receptor activation and ligand selectivity: crystal structures of five agonist complexes with the GluR2 ligand-binding core
A Hogner, JS Kastrup, R Jin, T Liljefors, ML Mayer, J Egebjerg, IK Larsen, ...
Journal of molecular biology 322 (1), 93-109, 2002
2012002
Competitive antagonism of AMPA receptors by ligands of different classes: crystal structure of ATPO bound to the GluR2 ligand-binding core, in comparison with DNQX
A Hogner, JR Greenwood, T Liljefors, ML Lunn, J Egebjerg, IK Larsen, ...
Journal of medicinal chemistry 46 (2), 214-221, 2003
1242003
Ligand binding mechanism in steroid receptors: from conserved plasticity to differential evolutionary constraints
K Edman, A Hosseini, MK Bjursell, A Aagaard, L Wissler, A Gunnarsson, ...
Structure 23 (12), 2280-2290, 2015
1092015
Three-Dimensional Structure of the Ligand-Binding Core of GluR2 in Complex with the Agonist (S)-ATPA:  Implications for Receptor Subunit Selectivity
ML Lunn, A Hogner, TB Stensbøl, E Gouaux, J Egebjerg, JS Kastrup
Journal of medicinal chemistry 46 (5), 872-875, 2003
692003
Discovery of (3-(4-(2-oxa-6-azaspiro [3.3] heptan-6-ylmethyl) phenoxy) azetidin-1-yl)(5-(4-methoxyphenyl)-1, 3, 4-oxadiazol-2-yl) methanone (AZD1979), a melanin concentrating …
A Johansson, C Lofberg, M Antonsson, S von Unge, MA Hayes, R Judkins, ...
Journal of Medicinal Chemistry 59 (6), 2497-2511, 2016
562016
CACHE (Critical Assessment of Computational Hit-finding Experiments): a public–private partnership benchmarking initiative to enable the development of computational methods …
S Ackloo, R Al-Awar, RE Amaro, CH Arrowsmith, H Azevedo, RA Batey, ...
Nature Reviews Chemistry 6 (4), 287-295, 2022
372022
Binding mode and induced fit predictions for prospective computational drug design
C Grebner, J Iegre, J Ulander, K Edman, A Hogner, C Tyrchan
Journal of Chemical Information and Modeling 56 (4), 774-787, 2016
332016
Exploring binding mechanisms in nuclear hormone receptors by Monte Carlo and X-ray-derived motions
C Grebner, D Lecina, V Gil, J Ulander, P Hansson, A Dellsen, C Tyrchan, ...
Biophysical journal 112 (6), 1147-1156, 2017
212017
3D-Lab: a collaborative web-based platform for molecular modeling
C Grebner, M Norrby, J Enström, I Nilsson, A Hogner, J Henriksson, ...
Future Medicinal Chemistry 8 (14), 1739-1752, 2016
212016
Identification of mineralocorticoid receptor modulators with low impact on electrolyte homeostasis but maintained organ protection
KL Granberg, ZQ Yuan, B Lindmark, K Edman, J Kajanus, A Hogner, ...
Journal of Medicinal Chemistry 62 (3), 1385-1406, 2018
192018
linàs AL, Wellner E. & Plowright AT
J Boström, A Hogner
J. Med. Chem 55, 1817-1830, 2012
182012
1, 3, 4-Oxadiazole and heteroaromatic-fused 1, 2, 4-triazole synthesis using diverted umpolung amide synthesis
K Tokumaru, K Bera, JN Johnston
Synthesis 49 (20), 4670-4675, 2017
162017
PELE-MSM: A monte carlo based protocol for the estimation of absolute binding free energies
JF Gilabert, C Grebner, D Soler, D Lecina, M Municoy, O Gracia Carmona, ...
Journal of chemical theory and computation 15 (11), 6243-6253, 2019
152019
Unraveling the allosteric cross-talk between the coactivator peptide and the ligand-binding site in the glucocorticoid receptor
G La Sala, A Gunnarsson, K Edman, C Tyrchan, A Hogner, AI Frolov
Journal of chemical information and modeling 61 (7), 3667-3680, 2021
132021
Structure‐Based Drug Design of Mineralocorticoid Receptor Antagonists to Explore Oxosteroid Receptor Selectivity
A Nordqvist, G O'Mahony, M Fridén‐Saxin, M Fredenwall, A Hogner, ...
ChemMedChem 12 (1), 50-65, 2017
132017
Membrane permeability in cyclic peptides is modulated by core conformations
F Cipcigan, P Smith, J Crain, A Hogner, L De Maria, A Llinas, E Ratkova
Journal of Chemical Information and Modeling 61 (1), 263-269, 2020
122020
Discovery by virtual screening of an inhibitor of CDK5-Mediated PPARγ phosphorylation
G O’Mahony, J Petersen, M Ek, R Rae, C Johansson, L Jianming, ...
ACS Medicinal Chemistry Letters 13 (4), 681-686, 2022
102022
Combining Monte Carlo and molecular dynamics simulations for enhanced binding free energy estimation through Markov state models
JF Gilabert, O Gracia Carmona, A Hogner, V Guallar
Journal of Chemical Information and Modeling 60 (11), 5529-5539, 2020
82020
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Artículos 1–20