Read e-book online Computational Approaches to Nuclear Receptors From PDF

By Pietro Cozzini, Glen E Kellogg, David E Thurston, Stefano Lorenzetti, Laura Narciso, Martin Safo, Javier Luque, Xavier Barril, Francesca Spyrakis, Ruben Abagyan, Wayne B Bosma, Michael Appell, Yan Zhang, Chris Arnatt, Chiara Dall'Asta, Andrea Faccini, Gia

ISBN-10: 1849733643

ISBN-13: 9781849733649

ISBN-10: 1849735352

ISBN-13: 9781849735353

Content material: Preface; creation; Nuclear receptors: connecting human well-being to the surroundings; Structural features, execs and cons of structural facts as a base for computational investigations; Protein constitution Prediction and research with Constraint common sense Programming; Molecular Dynamics: a device to appreciate Nuclear Receptors; Docking, screening and selectivity prediction for small molecule nuclear receptor modulators; Quantum chemical experiences of estrogenic pollution; Fluorescent rats to check computational stories; Homology modeling stories of a Nuclear G-protein Coupled Receptor GPER; From computational simulations on NR to chemosensors for nutrition protection

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Additional resources for Computational Approaches to Nuclear Receptors From Computational Simulation to In Vivo Experiments

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F. Rastinejad, T. Perlmann, R. M. Evans and P. B. Sigler, Nature, 1995, 375, 203. 50. I. Orlov, N.

NR antagonists sterically prevent helix H12 from adopting the agonist-induced conformation and may result in the AF-2 binding site being accessible to interact with the NR co-repressors. For instance, estrogen binding to the ER LBD induces a shift in helix H12, which closes the LBD pocket and provides a surface to which co-activators can bind. 64 Several structures of the GR ligand-binding domain (GR-LBD) with mifepristone show that the ligand triggers the helix H12 molecular switch to reshape the co-activator site into the co-repressor site 65.

Marcoccia, A. Di Virgilio, A. Eusepi, A. Romeo, A. Magrelli, M. Salvatore, F. Tosto, M. Viganotti, A. Antoccia, A. Di Masi, G. Azzalin, C. Tanzarella, G. Macino, D. Taruscio and A. Mantovani, Reprod. , 2010, 9(4), 427–432. S. Lorenzetti, V. Tassinari, M. Viganotti, F. Maranghi, G. Moracci, R. Tassinari, G. Azzalin, D. Marcoccia, A. Di Virgilio, A. Eusepi, A. Romeo, A. Magrelli, M. Salvatore, F. Tosto, A. Antoccia, A. Di Masi, C. Tanzarella, G. Macino, D. Taruscio and A. Mantovani, ISTISAN Congressi, 11/C6, 21–22.

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Computational Approaches to Nuclear Receptors From Computational Simulation to In Vivo Experiments by Pietro Cozzini, Glen E Kellogg, David E Thurston, Stefano Lorenzetti, Laura Narciso, Martin Safo, Javier Luque, Xavier Barril, Francesca Spyrakis, Ruben Abagyan, Wayne B Bosma, Michael Appell, Yan Zhang, Chris Arnatt, Chiara Dall'Asta, Andrea Faccini, Gia


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