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Interactions of connexins with other membrane channels and transporters
(Pergamon-Elsevier Science Ltd, 2007-05)
Cell-to-cell communication through gap junctions exists in most animal cells and is essential for many important biological processes including rapid transmission of electric signals to coordinate contraction of cardiac ...
Molecular Interatcions : The Multipole Expansion
(The Chemical Educator, 2012-11)
This laboratory provides students with the opportunity to reinforce their knowledge of the numerous parameters involved in electrophilic aromatic substitution reactions. These concepts are investigated using a benchtop ...
Structural basis for the potent inhibition of the HIV integrase-LEDGF/p75 protein–protein interaction
(Elsevier Science Inc, 2017-08)
Integrase (IN) constitutes one of the key enzymes involved in the lifecycle of the Human Immunodeficiency Virus (HIV), the etiological agent of AIDS. The biological role of IN strongly depends on the recognition and binding ...
Stereoelectronic interactions and molecular properties: An NBO-based study of uracil
(American Chemical Society, 2003-07)
The contributions of stereoelectronic interactions to several molecular properties are used to analyze the propagation of information between different parts of the uracil molecule with a method that is based on the natural ...
One-class models for validation of miRNAs and ERBB2 gene interactions based on sequence features for breast cancer scenarios
(Korean Institute of Communication SciencesKR, 2021)
One challenge in miRNA–genes–diseases interaction studies is that it is challenging to find labeled data that indicate a positive or negative relationship between miRNA and genes. The use of one-class classification methods ...
Double hole-lump interaction between halogen atoms
(American Chemical Society, 2015-03-31)
In this paper a theoretical study has been carried out to investigate the nature of the unusual halogen–halogen contacts in the complexes R–X···X–R (with R = −H, −Cl, −F and X = Cl, Br, I). AIM, NBO, and MEP analyses have ...
Interaction of gabaergic ketones with model membranes: A molecular dynamics and experimental approach
(Elsevier Science, 2018-08)
γ-Aminobutyric-acid receptor (GABA A -R), a membrane intrinsic protein, is activated by GABA and modulated by a wide variety of recognized drugs. GABA A -R is also target for several insecticides which act by recognition ...
Thyroid hormone interactions with dmpc bilayers. A molecular dynamics study
(American Chemical Society, 2009-12)
The structure and dynamics of thyroxine (T4), distal and proximal conformers of 3',3,5-triiodo-L-thyronine (T3d and T3p), and 3,5-diiodo-L- thyronine (T2) upon interaction with DMPC membranes were analyzed by means of ...
Plasmonic Interactions: From Molecular Plasmonics and Fano Resonances to Ferroplasmons
(American Chemical Society, 2014-10)
Plasmon interactions are a subject of great interest from both the technological as well as the fundamental points of view. In this Perspective, we outline the great variety of physical phenomena that are produced by the ...
Effect of pH on Eosin Y/PAMAM interactions studied from absorption spectroscopy and molecular dynamics simulations
(Elsevier Science, 2018-07)
Absorption spectroscopy experiments were carried out to examine the 1:1 supramolecular interaction between Eosin Y (EOS) and low generation G0-G3 poly(amido amine) (PAMAM) dendrimers at neutral and basic media, aimed at ...