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Moreira, Irina S
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ResearcherID: K-4711-2012
URL: http://www.researcherid.com/rid/K-4711-2012
Subject: Biochemistry & Molecular Biology; Biophysics; Chemistry; Computer Science; Mathematical & Computational Biology
Keywords: computational chemistry; structural biology; bioinformatics; molecular modeling; drug design and discovery; protein-ligand interactions; protein-protein interactions; gpcr/g-protein interactions; gpcr/arrestin interactions; computational mutagenesis; structure prediction; homology modeling; molecular dynamic simulations; binding free energy calculations; docking; data-mining; data science; statistics; machine-learning; computer science
ORCID: https://orcid.org/0000-0003-2970-5250
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My URLs: www.moreiralab.com
 
 

This list contains papers that I have authored.

publication(s)  
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1.  Title: In Silico Studies Targeting G-protein Coupled Receptors for Drug Research Against Parkinson's Disease.
 Author(s): Lemos A; Melo R; Preto AJ; et al.
 Source: Current neuropharmacology Published: 2018
 Times Cited: 0
 DOI: 10.2174/1570159X16666180308161642 /  Author-provided URL : http://europepmc.org/abstract/med/29521236
added
03-Jul-18
2.  Title: Prediction and Targeting of Interaction Interfaces in G-Protein Coupled Receptor Oligomers.
 Author(s): Schiedel AC; Kose M; Barreto C; et al.
 Source: Current topics in medicinal chemistry Published: 2018
 DOI: 10.2174/1568026618666180604082610 /  Author-provided URL : http://europepmc.org/abstract/med/29866008
added
03-Jul-18
3.  Title: Computational studies of G protein-coupled receptor complexes: Structure and dynamics
 Author(s): Sensoy, O.; Almeida, J. G.; Shabbir, J.; et al.
 Source: Methods Cell Biol Volume: 142 Pages: 205-245 Published: 2017
 DOI: 10.1016/bs.mcb.2017.07.011 /  Author-provided URL : https://www.ncbi.nlm.nih.gov/pubmed/28964337
added
03-Jan-18
4.  Title: Membrane proteins structures: A review on computational modeling tools
 Author(s): Jose G. Almeida; Antonio J. Preto; Panagiotis I. Koukos; et al.
 Source: Biochimica et Biophysica Acta (BBA) - Biomembranes Volume: 1859 Issue: 10 Pages: 2021--2039 Published: 2017
 Times Cited: 16
 DOI: 10.1016/j.bbamem.2017.07.008
added
13-Sep-17
5.  Title: Performance of HADDOCK and a simple contact-based protein-ligand binding affinity predictor in the D3R Grand Challenge 2.
 Source: Journal of computer-aided molecular design Published: 2017
 Times Cited: 3
 DOI: 10.1007/s10822-017-0038-1 /  Author-provided URL : http://europepmc.org/abstract/med/28831657
added
13-Sep-17
6.  Title: SpotOn: High Accuracy Identification of Protein-Protein Interface Hot-Spots
 Author(s): Irina S. Moreira; Panagiotis I. Koukos; Rita Melo; et al.
 Source: Scientific Reports Published: 2017
 Times Cited: 9
 DOI: 10.1038/s41598-017-08321-2
added
13-Sep-17
7.  Title: A Machine Learning Approach for Hot-Spot Detection at Protein-Protein Interfaces.
 Source: International journal of molecular sciences Published: 2016
 Times Cited: 11
 DOI: 10.3390/ijms17081215 /  Author-provided URL : http://europepmc.org/abstract/med/27472327
added
13-Sep-17
8.  Title: General AMBER Force Field Parameters for Diphenyl Diselenides and Diphenyl Ditellurides.
 Author(s): Torsello, Mauro; Pimenta, Antonio C; Wolters, Lando P; et al.
 Source: The journal of physical chemistry. A Volume: 120 Issue: 25 Pages: 4389-400 Published: 2016-Jun-30
 DOI: 10.1021/acs.jpca.6b02250
added
15-Jul-16
9.  Title: Understanding the Differential Selectivity of Arrestins toward the Phosphorylation State of the Receptor.
 Source: ACS chemical neuroscience Published: 2016
 Times Cited: 6
 DOI: 10.1021/acschemneuro.6b00073 /  Author-provided URL : http://europepmc.org/abstract/med/27405242
added
13-Sep-17
10.  Title: A new scoring function for protein-protein docking that identifies native structures with unprecedented accuracy
 Author(s): Moreira, Irina S.; Martins, Joao M.; Coimbra, Joa T. S.; et al.
 Source: Physical Chemistry Chemical Physics Volume: 17 Issue: 4 Pages: 2378-2387 Published: JAN 28 2015
 Times Cited: 7
 DOI: 10.1039/c4cp04688a
added
20-Jan-16
publication(s)  
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