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Thermodynamic Stabillity of Hydrogen-Bonded Systems in Polar and Nonpolar Environments
(JOHN WILEY & SONS INC, 2010)
The thermodynamic properties of a selected set of benchmark hydrogen-bonded systems (acetic acid dimer and the complexes of acetic acid with acetamide and methanol) was studied with the goal of obtaining detailed information ...
Aplicações do modelo molecular no estudo de complexos de positron: taxa de aniquilação, relaxação molecular e espalhamento
(Universidade Federal de Minas GeraisUFMG, 2009-10-02)
In this work we present applications of the molecular model to the study of positron interaction with atoms and molecules. In this model, the positron is treated as a light nucleus and its motion can be completely separated, ...
Puzzling challenges in contemporary neuroscience: Insights from complexity and emergence in epileptogenic circuits
(ACADEMIC PRESS INC ELSEVIER SCIENCE, 2009)
The brain is a complex system that, in the normal condition, has emergent properties like those associated with activity-dependent plasticity in learning and memory, and in pathological situations, manifests abnormal ...
Estudo do controle da dimensionalidade de nanomagnetos moleculares via química supramolecular
(Universidade Federal de Minas GeraisUFMG, 2013-03-01)
This work concerns the syntheses and study of magnetic properties of molecular systems which the dimensionality was controlled, and furthermore, presents the study of interactions between molecular systems and carbon ...
Exponential decay of a charge transfer induced by coordination in organometallic complexes
(Sociedad Chilena de Quimica, 2001)
In the series of organometallic complexes N3P2(X)5P-SPACER-MLn X= CI and OR, MLn= organometallic fragment, the A31 P-NMR coordination chemical shift parameter correlates with the length of the spacer, decaying exponentially ...
The Molecular Photo-Cell: Quantum Transport and Energy Conversion at Strong Non-Equilibrium
(Nature, 2015)
The molecular photo-cell is a single molecular donor-acceptor complex attached to electrodes and subject to
external illumination. Besides the obvious relevance to molecular photo-voltaics, the molecular photo-cell is
of ...
Thermodynamic and structural aspects of molecular recognition in mannose-binding protein complexes: a theoretical study over HRP-ArtinM association
(Springer, 2021-03-15)
The biomolecular recognition of D-mannose-binding lectin from Artocarpus heterophyllus (ArtinM) by Horseradish Peroxidase (HRP) mediated by glycosylation allows their application in a multitude of biological systems. The ...
An application of chemometric techniques to analyze the effects of the wave function modifications on the intermolecular stretching frequencies of the hydrogen-bonded complexes
(Elsevier Science BvAmsterdamHolanda, 2004)
PbGP43 Genotyping Using Paraffin-Embedded Biopsies of Human Paracoccidioidomycosis Reveals a Genetically Distinct Lineage in the Paracoccidioides brasiliensis Complex
(2021-01-01)
Paracoccidioidomycosis (PCM) is a systemic mycosis caused by a group of cryptic species embedded in the Paracoccidioides brasiliensis complex and Paracoccidioides lutzii. Four species were recently inferred to belong to ...