M. Natália Dias Soeiro Cordeiro
Orcid: 0000-0003-3375-8670
According to our database1,
M. Natália Dias Soeiro Cordeiro
authored at least 22 papers
between 1993 and 2023.
Collaborative distances:
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Bibliography
2023
Multi-model <i>in silico</i> characterization of 3-benzamidobenzoic acid derivatives as partial agonists of Farnesoid X receptor in the management of NAFLD.
Comput. Biol. Medicine, May, 2023
2021
J. Cheminformatics, 2021
2020
Understanding the Binding Specificity of G-Protein Coupled Receptors toward G-Proteins and Arrestins: Application to the Dopamine Receptor Family.
J. Chem. Inf. Model., 2020
2019
CompScore: Boosting Structure-Based Virtual Screening Performance by Incorporating Docking Scoring Function Components into Consensus Scoring.
J. Chem. Inf. Model., 2019
MitoTarget Modeling Using ANN-Classification Models Based on Fractal SEM Nano-Descriptors: Carbon Nanotubes as Mitochondrial F0F1-ATPase Inhibitors.
J. Chem. Inf. Model., 2019
QSAR-Co: An Open Source Software for Developing Robust Multitasking or Multitarget Classification-Based QSAR Models.
J. Chem. Inf. Model., 2019
New Workflow for QSAR Model Development from Small Data Sets: Small Dataset Curator and Small Dataset Modeler. Integration of Data Curation, Exhaustive Double Cross-Validation, and a Set of Optimal Model Selection Techniques.
J. Chem. Inf. Model., 2019
2018
Q2DTor: A program to treat torsional anharmonicity through coupled pair torsions in flexible molecules.
Comput. Phys. Commun., 2018
Mr. Silva and Patient Zero: A Medical Social Network and Data Visualization Information System.
Proceedings of the Simulation, Image Processing, and Ultrasound Systems for Assisted Diagnosis and Navigation, 2018
2016
First Multitarget Chemo-Bioinformatic Model To Enable the Discovery of Antibacterial Peptides against Multiple Gram-Positive Pathogens.
J. Chem. Inf. Model., 2016
2015
Solvent Accessible Surface Area-Based Hot-Spot Detection Methods for Protein-Protein and Protein-Nucleic Acid Interfaces.
J. Chem. Inf. Model., 2015
Harmonization of QSAR Best Practices and Molecular Docking Provides an Efficient Virtual Screening Tool for Discovering New G-Quadruplex Ligands.
J. Chem. Inf. Model., 2015
2014
J. Chem. Inf. Model., 2014
Molecular Dynamics Simulations of Complex Mixtures Aimed at the Preparation of Naproxen-Imprinted Xerogels.
J. Chem. Inf. Model., 2014
2013
Chemoinformatics in Drug Design. Artificial Neural Networks for Simultaneous Prediction of Anti-enterococci Activities and Toxicological Profiles.
Proceedings of the IJCCI 2013, 2013
2011
Two New Parameters Based on Distances in a Receiver Operating Characteristic Chart for the Selection of Classification Models.
J. Chem. Inf. Model., 2011
Jointly Handling Potency and Toxicity of Antimicrobial Peptidomimetics by Simple Rules from Desirability Theory and Chemoinformatics.
J. Chem. Inf. Model., 2011
2010
On the stability of metal-aminoacid complexes in water based on water-ligand exchange reactions and electronic properties: Detailed study on iron-glycine hexacoordinated complexes.
J. Comput. Chem., 2010
2008
Desirability-based multiobjective optimization for global QSAR studies: Application to the design of novel NSAIDs with improved analgesic, antiinflammatory, and ulcerogenic profiles.
J. Comput. Chem., 2008
2007
Computational chemistry approach for the early detection of drug-induced idiosyncratic liver toxicity.
J. Comput. Chem., 2007
2000
J. Chem. Inf. Comput. Sci., 2000
1993
<i>Ab initio</i> copper-water interaction potential for the simulation of aqueous solutions.
J. Comput. Chem., 1993