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List of works by César R García-Jacas

Choquet integral-based fuzzy molecular characterizations: when global definitions are computed from the dependency among atom/bond contributions (LOVIs/LOEIs)

scientific article published on 25 October 2018

Conformation-dependent QSAR approach for the prediction of inhibitory activity of bromodomain modulators

scientific article published on 6 February 2017

Constraining the Prebiotic Cell Size Limits in Extremely Hostile Environments: A Dynamical Perspective.

scientific article published in April 2018

Database fingerprint (DFP): an approach to represent molecular databases

scientific article

Distributed and multicore QuBiLS-MIDAS software v2.0: Computing chiral, fuzzy, weighted and truncated geometrical molecular descriptors based on tensor algebra

scientific article published on 14 February 2020

Drug repositioning for novel antitrichomonas from known antiprotozoan drugs using hierarchical screening

scientific article published on 28 March 2018

Enhancing Acute Oral Toxicity Predictions by using Consensus Modeling and Algebraic Form-Based 0D-to-2D Molecular Encodes

scientific article published on 17 May 2019

Ensemble Models Based on QuBiLS-MAS Features and Shallow Learning for the Prediction of Drug-Induced Liver Toxicity: Improving Deep Learning and Traditional Approaches

scientific article published on 14 May 2020

Examining the predictive accuracy of the novel 3D N-linear algebraic molecular codifications on benchmark datasets

scientific article (publication date: 2016)

GOWAWA Aggregation Operator-based Global Molecular Characterizations: Weighting Atom/bond Contributions (LOVIs/LOEIs) According to their Influence in the Molecular Encoding

scientific article published on 02 August 2018

IMMAN: free software for information theory-based chemometric analysis

scientific article published on 26 January 2015

LEGO-based generalized set of two linear algebraic 3D bio-macro-molecular descriptors: Theory and validation by QSARs

scientific article published on 04 October 2019

MuLiMs-MCoMPAs: A Novel Multiplatform Framework to Compute Tensor Algebra-Based Three-Dimensional Protein Descriptors

scientific article published on 30 October 2019

Multi-Server Approach for High-Throughput Molecular Descriptors Calculation based on Multi-Linear Algebraic Maps.

scientific article published on 28 November 2014

N-Linear Algebraic Maps for Chemical Structure Codification: A Suitable Generalization for Atom-pair Approaches?

article

N-tuple topological/geometric cutoffs for 3D N-linear algebraic molecular codifications: variability, linear independence and QSAR analysis.

scientific article

Novel 3D bio-macromolecular bilinear descriptors for protein science: Predicting protein structural classes.

scientific article published on 3 April 2015

Novel global and local 3D atom-based linear descriptors of the Minkowski distance matrix: theory, diversity–variability analysis and QSPR applications

article

Optimum Search Strategies or Novel 3D Molecular Descriptors: is there a Stalemate?

article

Predicting reactive sites with quantum chemical topology: carbonyl additions in multicomponent reactions

scientific article published on 20 April 2020

QuBiLS-MAS, open source multi-platform software for atom- and bond-based topological (2D) and chiral (2.5D) algebraic molecular descriptors computations

scientific article published on 7 June 2017

QuBiLS-MIDAS: a parallel free-software for molecular descriptors computation based on multilinear algebraic maps

scientific article

Smoothed Spherical Truncation based on Fuzzy Membership Functions: Application to the Molecular Encoding

scientific article published on 24 October 2019

Tensor Algebra-based Geometrical (3D) Biomacro-Molecular Descriptors for Protein Research: Theory, Applications and Comparison with other Methods

scientific article published on 06 August 2019

Tensor algebra-based geometric methodology to codify central chirality on organic molecules

scientific article

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