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Results 11 - 20 of about 68
Original articles in indexed journals - GPCR Drug Discovery
Kapla J, Rodríguez-Espigares I, Ballante F, Selent J, Carlsson J. Can molecular dynamics simulations improve the structural accuracy and virtual screening performance of GPCR models? . PLoS Comput Biol, 2021; 17(5): e1008936. PMID: 33983933 . DOI: 10.1371/journal.pcbi.1008936.
2021
Original articles in indexed journals - GPCR Drug Discovery
Ågren R, Stepniewski TM, Zeberg H, Selent J, Sahlholm K. Dopamine D2 Receptor Agonist Binding Kinetics-Role of a Conserved Serine Residue. Int J Mol Sci, 2021; 22 (8): 4078. PMID: 33920848 . DOI: 10.3390/ijms22084078.
2021
Original articles in indexed journals - GPCR Drug Discovery
Koklič T, Hrovat A, Guixà-González R, Rodríguez-Espigares I, Navio D, Frangež R, Uršič M, Kubale V, Plemenitaš A, Selent J, Šentjurc M, Vrecl M. Electron Paramagnetic Resonance Gives Evidence for the Presence of Type 1 Gonadotropin-Releasing Hormone Receptor (GnRH-R) in Subdomains of Lipid Rafts. Molecules. 2021; 26(4):973. PMID: 33673080 . DOI: 10.3390/molecules26040973.
2021
Original articles in indexed journals - GPCR Drug Discovery
Ågren R, Zeberg H, Stępniewski TM, Free RB, Reilly SW, Luedtke RR, Århem P, Ciruela F, Sibley DR, Mach RH, Selent J, Nilsson J, Sahlholm K. Ligand with Two Modes of Interaction with the Dopamine D2 Receptor-An Induced-Fit Mechanism of Insurmountable Antagonism. ACS Chem Neurosci, 2020; 11(19):3130-3143. PMID: 32865974 . DOI: 10.1021/acschemneuro.0c00477.
2020
Original articles in indexed journals - GPCR Drug Discovery
Dwivedi-Agnihotri H, Chaturvedi M, Baidya M, Stepniewski TM, Pandey S, Maharana J, Srivastava A, Caengprasath N, Hanyaloglu AC, Selent J, Shukla AK. Distinct phosphorylation sites in a prototypical GPCR differently orchestrate beta-arrestin interaction, trafficking, and signaling. Sci Adv, 2020; 6 (37): eabb8368. PMID: 32917711 . DOI: 10.1126/sciadv.abb8368.
2020
Original articles in indexed journals - GPCR Drug Discovery
Baidya M, Kumari P, Dwivedi-Agnihotri H, Pandey S, Chaturvedi M, Stepniewski T, Kawakami K, Cao Y, Laporte SA, Selent J, Inoue A, Shukla AK. Key phosphorylation sites in GPCRs orchestrate the contribution of ?-Arrestin 1 in ERK1/2 activation. Embo Rep, 2020; e49886. PMID: 32715625 . DOI: 10.15252/embr.201949886.
2020
Original articles in indexed journals - GPCR Drug Discovery
Torrens-Fontanals M, Stepniewski TM, Aranda-García D, Morales-Pastor A, Medel-Lacruz B, Selent J. How Do Molecular Dynamics Data Complement Static Structural Data of GPCRs. Int J Mol Sci, 2020; 21(16):5933. PMID: 32824756 . DOI: 10.3390/ijms21165933.
2020
Original articles in indexed journals - Integrative Biomedical Informatics - Computational Science - GPCR Drug Discovery
Rodríguez-Espigares I, Torrens-Fontanals M, Tiemann JKS et al (including Selent J, Sanz F, de Fabritiis G). GPCRmd uncovers the dynamics of the 3D-GPCRome. Nat Methods, 2020; 17(8): 777-787. PMID: 32661425 . DOI: 10.1038/s41592-020-0884-y .
2020
Original articles in indexed journals - GPCR Drug Discovery
Jaiteh M, Rodríguez-Espigares I, Selent J, Carlsson J. Performance of virtual screening against GPCR homology models: Impact of template selection and treatment of binding site plasticity. PLoS Comput Biol, 2020; 16(3): e1007680. PMID: 32168319 . DOI: 10.1371/journal.pcbi.1007680.
2020
Original articles in indexed journals - GPCR Drug Discovery
Sommer ME, Selent J, Carlsson J, De Graaf C, Gloriam DE, Keseru GM, Kosloff M, Mordalski S, Rizk A, Rosenkilde MM, Sotelo E, Tiemann JKS, Tobin A, Vardjan N, Waldhoer M, Kolb P. The European Research Network on Signal Transduction (ERNEST): Toward a Multidimensional Holistic Understanding of G Protein-Coupled Receptor Signaling. ACS Pharmacol Transl Sci, 2020; 3(2): 361-370. PMID: 32296774 . DOI: 10.1021/acsptsci.0c00024.
2020
