List of works by Pablo Román Duchowicz

Advances in the replacement and enhanced replacement method in QSAR and QSPR theories.

scientific article published on 22 June 2011

Amino acid profiles and quantitative structure-property relationship models as markers for Merlot and Torrontés wines

scientific article

An improved QSPR modeling of hydrocarbon dipole moments.

scientific article published on 18 November 2004

An integrated drug development approach applying topological descriptors

scientific article published on September 2012

Anti-T. cruzi activities and QSAR studies of 3-arylquinoxaline-2-carbonitrile di-N-oxides

scientific article published on 25 June 2010

Application of quantitative structure-property relationship analysis to estimate the vapor pressure of pesticides

scientific article published on 15 February 2016

Conformation-Independent QSPR Approach for the Soil Sorption Coefficient of Heterogeneous Compounds

scientific article

Exploring 3-arylquinoxaline-2-carbonitrile 1,4-di-N-oxides activities against neglected diseases with QSAR.

scientific article published on 11 May 2010

Gaussian-3 study of the thermochemistry of the germane and its fluoro chloro derivatives

scientific article published on 13 June 2008

Lacosamide derivatives with anticonvulsant activity as carbonic anhydrase inhibitors. Molecular modeling, docking and QSAR analysis

scientific article published in January 2014

Linear Regression QSAR Models for Polo-Like Kinase-1 Inhibitors

scientific article published on 14 February 2018

New QSPR study for the prediction of aqueous solubility of drug-like compounds.

scientific article published on 29 July 2008

New hybrid genetic based Support Vector Regression as QSAR approach for analyzing flavonoids-GABA(A) complexes.

scientific article published in June 2009

Partial order theory applied to QSPR-QSAR studies

scientific article published on December 2008

Predicting the bioconcentration factor through a conformation-independent QSPR study

scientific article published on 2 October 2017

Prediction of drug intestinal absorption by new linear and non-linear QSPR.

scientific article published on 9 November 2010

Predictive QSPR study of the dissociation constants of diverse pharmaceutical compounds

scientific article published on November 2010

QSAR analysis for heterocyclic antifungals.

scientific article published on 24 January 2007

QSAR analysis for quinoxaline-2-carboxylate 1,4-di-N-oxides as anti-mycobacterial agents

scientific article

QSAR analysis of plant-derived compounds with larvicidal activity against Zika Aedes aegypti (Diptera: Culicidae) vector using freely available descriptors

scientific article published on 4 January 2018

QSAR analysis on Spodoptera litura antifeedant activities for flavone derivatives

scientific article published on 20 October 2009

QSAR analysis on tacrine-related acetylcholinesterase inhibitors

scientific article

QSAR applications during last decade on inhibitors of acetylcholinesterase in Alzheimer's disease

scientific article published on September 2012

QSAR for non-nucleoside inhibitors of HIV-1 reverse transcriptase.

scientific article published in September 2006

QSAR modeling of the inhibition of glycogen synthase kinase-3.

scientific article published on 2 May 2006

QSAR modeling of the interaction of flavonoids with GABA(A) receptor

scientific article published on 22 November 2007

QSAR models for thiophene and imidazopyridine derivatives inhibitors of the Polo-Like Kinase 1.

scientific article

QSAR prediction of inhibition of aldose reductase for flavonoids

scientific article published on 10 June 2008

QSAR studies for the pharmacological inhibition of glycogen synthase kinase-3.

scientific article published on July 2007

QSAR study and molecular design of open-chain enaminones as anticonvulsant agents

scientific article published on 14 December 2011

QSAR study for carcinogenicity in a large set of organic compounds

scientific article

QSPR Study of Valproic Acid and Its Functionalized Derivatives.

scientific article published on 8 February 2012

QSPR modeling the aqueous solubility of alcohols by optimization of correlation weights of local graph invariants

scientific article published in January 2004

QSPR studies on aqueous solubilities of drug-like compounds

scientific article published on 03 June 2009

QSPR study on refractive indices of solvents commonly used in polymer chemistry using flexible molecular descriptors

scientific article published on 30 July 2015

QSPR/QSAR Analyses by Means of the CORAL Software

Quantitative Structure-Antifungal Activity Relationships for cinnamate derivatives

scientific article

Quantitative structure-activity relationships of mosquito larvicidal chalcone derivatives

scientific article published on 3 January 2012

Replacement method and enhanced replacement method versus the genetic algorithm approach for the selection of molecular descriptors in QSPR/QSAR theories.

scientific article published in September 2010

Sustainable synthesis of flavonoid derivatives, QSAR study and insecticidal activity against the fall armyworm, Spodoptera frugiperda (Lep.: Noctuidae).

scientific article published on May 2010

The Monte Carlo method based on eclectic data as an efficient tool for predictions of endpoints for nanomaterials - two examples of application

scientific article

The Use of the Index of Ideality of Correlation to Build Up Models for Bioconcentration Factor

scientific article published on 13 January 2020

The conformation-independent QSPR approach for predicting the oxidation rate constant of water micropollutants.

scientific article published on 3 October 2017

The quantitative structure-insecticidal activity relationships from plant derived compounds against chikungunya and zika Aedes aegypti (Diptera:Culicidae) vector

scientific article published on 19 August 2017

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