Irina S. Moreira

According to our database, Irina S. Moreira authored at least 15 papers between 2003 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2024

p<i>K</i>_a Calculations of GPCRs: Understanding Protonation States in Receptor Activation.

Carlos A. V. Barreto, João N. M. Vitorino, Pedro B. P. S. Reis, Miguel Machuqueiro, Irina S. Moreira

J. Chem. Inf. Model., 2024

2023

DELFOS - drug efficacy leveraging forked and specialized networks - benchmarking scRNA-seq data in multi-omics-based prediction of cancer sensitivity.

Luiz Felipe Piochi, António J. Preto, Irina S. Moreira

Bioinform., October, 2023

2022

DrugTax: package for drug taxonomy identification and explainable feature extraction.

António J. Preto, Paulo C. Correia, Irina S. Moreira

J. Cheminformatics, 2022

2021

SicknessMiner: a deep-learning-driven text-mining tool to abridge disease-disease associations.

Nícia Rosário-Ferreira, Victor Guimarães, Vítor Santos Costa, Irina S. Moreira

BMC Bioinform., 2021

MENSAdb: a thorough structural analysis of membrane protein dimers.

Pedro Matos-Filipe, António J. Preto, Panagiotis I. Koukos, Joana Mourão, Alexandre M. J. J. Bonvin, Irina S. Moreira

Database J. Biol. Databases Curation, 2021

Predicting Hot Spots Using a Deep Neural Network Approach.

António J. Preto, Pedro Matos-Filipe, José G. de Almeida, Joana Mourão, Irina S. Moreira

Proceedings of the Artificial Neural Networks - Third Edition., 2021

2020

Understanding the Binding Specificity of G-Protein Coupled Receptors toward G-Proteins and Arrestins: Application to the Dopamine Receptor Family.

António J. Preto, Carlos A. V. Barreto, Salete J. Baptista, José G. de Almeida, Agostinho Lemos, André Melo, M. Natália Dias Soeiro Cordeiro, Zeynep Kurkcuoglu, Rita Melo, Irina S. Moreira

J. Chem. Inf. Model., 2020

2018

Performance of HADDOCK and a simple contact-based protein-ligand binding affinity predictor in the D3R Grand Challenge 2.

Zeynep Kurkcuoglu, Panagiotis I. Koukos, Nevia Citro, Mikael E. Trellet, João P. G. L. M. Rodrigues, Irina S. Moreira, Jorge Roel-Touris, Adrien S. J. Melquiond, Cunliang Geng, Jörg Schaarschmidt, Li C. Xue, Anna Vangone, Alexandre M. J. J. Bonvin

J. Comput. Aided Mol. Des., 2018

2015

Solvent Accessible Surface Area-Based Hot-Spot Detection Methods for Protein-Protein and Protein-Nucleic Acid Interfaces.

Cristian R. Munteanu, António César Pimenta, Carlos Fernandez-Lozano, André Melo, M. N. D. S. Cordeiro, Irina S. Moreira

J. Chem. Inf. Model., 2015

2014

Dynamic Structure of NGF and proNGF Complexed with p75NTR: Pro-Peptide Effect.

António César Pimenta, Daniel F. A. R. Dourado, João M. Martins, André Melo, M. N. Dias Soeiro Cordeiro, Ramiro D. Almeida, Giulia Morra, Irina S. Moreira

J. Chem. Inf. Model., 2014

2013

Ligand-Induced Structural Changes in TEM-1 Probed by Molecular Dynamics and Relative Binding Free Energy Calculations.

António César Pimenta, João M. Martins, Ruben Fernandes, Irina S. Moreira

J. Chem. Inf. Model., 2013

Extending the applicability of the O-ring theory to protein-DNA complexes.

R. M. Ramos, L. F. Fernandes, Irina S. Moreira

Comput. Biol. Chem., 2013

2010

Protein-protein docking dealing with the unknown.

Irina S. Moreira, Pedro Alexandrino Fernandes, Maria João Ramos

J. Comput. Chem., 2010

2007

Computational alanine scanning mutagenesis - An improved methodological approach.

Irina S. Moreira, Pedro Alexandrino Fernandes, Maria João Ramos

J. Comput. Chem., 2007

2003

New designs for MRI contrast agents.

Pedro Alexandrino Fernandes, Alexandra T. P. Carvalho, A. T. Marques, A. L. F. Pereira, A. P. S. Madeira, Ana Sofia P. Ribeiro, A. F. R. Carvalho, E. T. A. Ricardo, F. J. V. Pinto, Hélder A. Santos, H. D. G. Mangericão, H. M. Martins, H. D. B. Pinto, Hugo R. R. Santos, Irina S. Moreira, M. J. V. Azeredo, R. P. S. Abreu, R. M. S. Oliveira, Sergio F. Sousa, R. J. A. M. Silva, Z. S. Mourão, Maria João Ramos

J. Comput. Aided Mol. Des., 2003