Carlos J. V. Simões

According to our database1, Carlos J. V. Simões authored at least 10 papers between 2009 and 2022.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of four.

Timeline

Legend:

Book 
In proceedings 
Article 
PhD thesis 
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Links

On csauthors.net:

Bibliography

2022
Correction to: Designing optimized drug candidates with Generative Adversarial Network.
J. Cheminformatics, 2022

Designing optimized drug candidates with Generative Adversarial Network.
J. Cheminformatics, 2022

Explainable deep drug-target representations for binding affinity prediction.
BMC Bioinform., 2022

2017
Predicting hydrophobic solvation by molecular simulation: 1. Testing united-atom alkane models.
J. Comput. Chem., 2017

2014
A Machine Learning Approach to Enhance Scoring Performance in Docking-Based Virtual Screening Experiments: COX-1 as a Case Study.
Proceedings of the International Work-Conference on Bioinformatics and Biomedical Engineering, 2014

2011
A Relational Learning Approach to Structure-Activity Relationships in Drug Design Toxicity Studies.
J. Integr. Bioinform., 2011

Assessing the Effect of 2D Fingerprint Filtering on ILP-Based Structure-Activity Relationships Toxicity Studies in Drug Design.
Proceedings of the 5th International Conference on Practical Applications of Computational Biology & Bioinformatics, 2011

2010
Toward the Discovery of Functional Transthyretin Amyloid Inhibitors: Application of Virtual Screening Methods.
J. Chem. Inf. Model., 2010

Searching for Anti-Amyloid Drugs with the Help of Citizens: the "AMILOIDE" Project on the IBERCIVIS Platform.
ERCIM News, 2010

2009
Comparative Study of Classification Algorithms Using Molecular Descriptors in Toxicological DataBases.
Proceedings of the Advances in Bioinformatics and Computational Biology, 2009


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