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Bond Fukui Functions As Descriptor of the Electron Density Reorganization in pi Conjugated Systems
(AMER CHEMICAL SOC, 2012-01-06)
The bond Fukui function is introduced and tested as a new reactivity index capable of predicting the evolution of bond breaking and formation processes during an organic reaction involving pi conjugated systems. As an ...
Bond Fukui Functions As Descriptor of the Electron Density Reorganization in π Conjugated Systems
(American Chemical Society, 2011-11-29)
The bond Fukui function is introduced and tested as a new reactivity index
capable of predicting the evolution of bond breaking and formation processes during an
organic reaction involving π conjugated systems. As an ...
How Changes in the Sequence of the Peptide CLPFFD-NH2 Can Modify the Conjugation and Stability of Gold Nanoparticles and Their Affinity for B-Amyloid Fibrils
(American Chemical Society, 2008-05-30)
In a previous work, we studied the interaction of -amyloid fibrils (A ) with gold nanoparticles (AuNP) conjugated
with the peptide CLPFFD-NH2. Here, we studied the effect of changing the residue sequence of the ...
Long-term trajectories of intergenerational coresidence: Evidence of living arrangements patterns in Chile
(SPRINGER INTERNATIONAL PUBLISHING AG, 2022)
Objective This study examines long-term trajectories of intergenerational coresidence (IC) among a cohort of individuals aged 65 and 75 in Chile, focusing on their diversity, prevalence, internal dynamism, and sociodemographic ...
A Hydrogen Bond Rationale for the Enantioselective beta-Alkenylboration of Enones Catalyzed by O-Monoacyltartaric Acids
(American Chemical Society, 2014-06)
DFT calculations suggest that O-monoacyl L-tartaric acids catalyze the asymmetric conjugate alkenylboration of enones through transition structures that are stabilized by hydrogen-bonding interactions. Formation of a ...
Relação conjugal, violência psicológica e complementaridade fusional
(Departamento de Psicologia da Pontifícia Universidade Católica do Rio de Janeiro, 2008)
Neste artigo abordamos um tipo específico de dinâmica conjugal marcada pela violência psicológica. Na clínica com casais, temos observado situações nas quais são utilizadas agressões verbais e humilhações, que afetam a ...
Solvation of monoacidic conjugate bases and calculation of acidity constants in aqueous solution
(Trade Science Inc., 2006-05)
With the specific aim of analyzing the interactions of monoacidic conjugate bases with the solvent, equations that describe several reactions and equilibria of ionization were proposed. Furthermore, to prove the validity ...
Zymography of Hybrid Layers Created Using Extrafibrillar Demineralization
(2018-04-01)
A chelate-and-rinse extrafibrillar calcium chelation dentin bonding concept has recently been developed and investigated for its effectiveness in improving resin-dentin bonding by bridging the gap between wet and dry dentin ...
Coumarins from Free ortho-Hydroxy Cinnamates by Heck-Matsuda Arylations: A Scalable Total Synthesis of (R)-Tolterodine
(Amer Chemical SocWashingtonEUA, 2012)