Development of QSAR-based (MLR/ANN) predictive models for effective design of pyridazine corrosion inhibitors
Taiwo W. Quadri, Lukman O. Olasunkanmi, Ekemini D. Akpan, Omolola E. Fayemi, Han‐Seung Lee, Hassane Lgaz, Chandrabhan Verma, Lei Guo, Savaş Kaya, Eno E. Ebenso
Topics & Concepts
PyridazineQuantitative structure–activity relationshipMolecular descriptorArtificial neural networkLinear regressionDensity functional theoryMaterials scienceComputational chemistryBiological systemMachine learningComputer scienceChemistryOrganic chemistryBiologyMulticomponent Synthesis of HeterocyclesCorrosion Behavior and InhibitionComputational Drug Discovery Methods