Irina S. Moreira

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Fernandes, P. A.Professor of Chemistry and Biochemistry, University of Porto, PortugalVerifierad e-postadress på fc.up.pt
António José Preto Martins GomesBioinformatics Researcher, University of CoimbraVerifierad e-postadress på uc.pt
Rita MeloCentro de Ciências e Tecnologias Nucleares, Instituto Superior TécnicoVerifierad e-postadress på ctn.ist.utl.pt
José Guilherme de AlmeidaPredoctoral Fellow @ EMBL-EBIVerifierad e-postadress på ebi.ac.uk
Harel WeinsteinProfessor and Chairman, Physiology and Biophysics, Weill Cornell Medical College of CornellVerifierad e-postadress på med.cornell.edu
Alexandre M.J.J. BonvinProfessor of Computational Structural Biology, Bijvoet Center for Biomolecular Research, Faculty ofVerifierad e-postadress på uu.nl
João M. MartinsPost-Doctoral Research Scientist, Department of Computer Science, University of CopenhagenVerifierad e-postadress på di.ku.dk
Rui Miguel RamosREQUIMTE/LAQV - Faculdade de Ciências da Universidade do PortoVerifierad e-postadress på fc.up.pt
Jonathan JavitchVerifierad e-postadress på cumc.columbia.edu
Natalia CordeiroLAQV@REQUIMTE - Faculty of Sciences - University of PortoVerifierad e-postadress på fc.up.pt
Jörg SchaarschmidtKarlsruhe Institute of TechnologyVerifierad e-postadress på kit.edu
Carlos A.V. BarretoCNC, Coimbra, PortugalVerifierad e-postadress på cnc.uc.pt
Sergio F. SousaBioSIM, Universidade do PortoVerifierad e-postadress på med.up.pt
Mikael TrelletUtrecht UniversityVerifierad e-postadress på uu.nl
Zeynep H. GümüşMount Sinai School of Medicine, Weill Cornell Medical CollegeVerifierad e-postadress på mssm.edu
Madsen KLuniversity of copenhagenVerifierad e-postadress på ku.dk
Ulrik GetherUniversity of CopenhagenVerifierad e-postadress på sund.ku.dk
Kristian StrømgaardProfessor i kemisk biologi, Københavns UniversitetVerifierad e-postadress på sund.ku.dk
Anders BachVerifierad e-postadress på sund.ku.dk
Ozge SensoyIstanbul Medipol UniversityVerifierad e-postadress på medipol.edu.tr

Irina S. Moreira

University of Coimbra, Life Sciences Department; Center for Neuroscience and Cell Biology

Verifierad e-postadress på cnc.uc.pt - Startsida

Artificial Intelligence Drug Design Bioinformatics Computational Chemistry Structural Biology


Titel Sortera efter citat Sortera efter år Sortera efter titel	Citeras av Citeras av	År
Hot spots—A review of the protein–protein interface determinant amino‐acid residues IS Moreira, PA Fernandes, MJ Ramos Proteins: Structure, Function, and Bioinformatics 68 (4), 803-812, 2007	741	2007
Allosteric communication between protomers of dopamine class A GPCR dimers modulates activation Y Han, IS Moreira, E Urizar, H Weinstein, JA Javitch Nature chemical biology 5 (9), 688-695, 2009	354	2009
Computational alanine scanning mutagenesis—an improved methodological approach IS Moreira, PA Fernandes, MJ Ramos Journal of Computational Chemistry 28 (3), 644-654, 2007	212	2007
Protein–protein docking dealing with the unknown IS Moreira, PA Fernandes, MJ Ramos Journal of computational chemistry 31 (2), 317-342, 2010	135	2010
Vascular endothelial growth factor (VEGF) inhibition-a critical review I Sousa Moreira, P Alexandrino Fernandes, M Joao Ramos Anti-cancer agents in medicinal chemistry (formerly current medicinal …, 2007	133	2007
Structural features of the G-protein/GPCR interactions IS Moreira Biochimica et Biophysica Acta (BBA) - General Subjects, In press, 2013	121	2013
Identification of a small-molecule inhibitor of the PICK1 PDZ domain that inhibits hippocampal LTP and LTD TS Thorsen, KL Madsen, N Rebola, M Rathje, V Anggono, A Bach, ... Proceedings of the National Academy of Sciences 107 (1), 413-418, 2010	116	2010
Unraveling the importance of protein− protein interaction: Application of a computational alanine-scanning mutagenesis to the study of the IgG1 streptococcal protein G (C2 … IS Moreira, PA Fernandes, MJ Ramos The Journal of Physical Chemistry B 110 (22), 10962-10969, 2006	77	2006
Membrane proteins structures: A review on computational modeling tools JG Almeida, AJ Preto, PI Koukos, AMJJ Bonvin, IS Moreira Biochimica et Biophysica Acta (BBA)-Biomembranes 1859 (10), 2021-2039, 2017	59	2017
Computational Alanine Scanning Mutagenesis: MMPBSA vs TI SA Martins, MAS Perez, IS Moreira, SF Sousa, MJ Ramos, PA Fernandes Journal of Chemical Theory and Computation, 2013	55	2013
SpotOn: high accuracy identification of protein-protein interface hot-spots IS Moreira, PI Koukos, R Melo, JG Almeida, AJ Preto, J Schaarschmidt, ... Scientific reports 7 (1), 1-11, 2017	49	2017
Performance of HADDOCK and a simple contact-based protein–ligand binding affinity predictor in the D3R Grand Challenge 2 Z Kurkcuoglu, PI Koukos, N Citro, ME Trellet, J Rodrigues, IS Moreira, ... Journal of computer-aided molecular design 32 (1), 175-185, 2018	43	2018
Hot spot occlusion from bulk water: a comprehensive study of the complex between the lysozyme HEL and the antibody FVD1. 3 IS Moreira, PA Fernandes, MJ Ramos The Journal of Physical Chemistry B 111 (10), 2697-2706, 2007	43	2007
Evolution of drug resistance: insight on TEM β-lactamases structure and activity and β-lactam antibiotics AC Pimenta, R Fernandes, IS Moreira Mini reviews in medicinal chemistry 14 (2), 111-122, 2014	42	2014
Unravelling Hot Spots: a comprehensive computational mutagenesis study IS Moreira, PA Fernandes, MJ Ramos Theoretical Chemistry Accounts 117 (1), 99-113, 2007	42	2007
Accuracy of the numerical solution of the Poisson–Boltzmann equation IS Moreira, PA Fernandes, MJ Ramos Journal of Molecular Structure: THEOCHEM 729 (1-2), 11-18, 2005	36	2005
A machine learning approach for hot-spot detection at protein-protein interfaces R Melo, R Fieldhouse, A Melo, JDG Correia, MNDS Cordeiro, ZH Gümüş, ... International journal of molecular sciences 17 (8), 1215, 2016	34	2016
Understanding the importance of the aromatic amino-acid residues as hot-spots IS Moreira, JM Martins, RM Ramos, PA Fernandes, MJ Ramos Biochimica et Biophysica Acta (BBA)-Proteins and Proteomics 1834 (1), 404-414, 2013	32	2013
Protein–protein recognition: a computational mutagenesis study of the MDM2–P53 complex IS Moreira, PA Fernandes, MJ Ramos Theoretical Chemistry Accounts 120 (4), 533-542, 2008	32	2008
Structure–activity relationships of a small-molecule inhibitor of the PDZ domain of PICK1 A Bach, N Stuhr-Hansen, TS Thorsen, N Bork, IS Moreira, K Frydenvang, ... Organic & biomolecular chemistry 8 (19), 4281-4288, 2010	30	2010

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