Study of organic reactions using chemical reactivity descriptors derived through a temperature-dependent approach
Marco Franco‐Pérez, Carlos A. Polanco-Ramírez, José L. Gázquez, Paul W. Ayers, Alberto Vela
Topics & Concepts
Fukui functionReactivity (psychology)ChemistryNucleophileChemical reactionElectrophileComputational chemistryDensity functional theoryMarkovnikov's ruleChemical physicsOrganic chemistryRegioselectivityCatalysisAlternative medicinePathologyMedicineComputational Drug Discovery MethodsAdvanced Chemical Physics StudiesMachine Learning in Materials Science