“…The size of TCE1-6 and the nature of the heteroatoms (N, O and S) have been systematically changed to examine the effect of these factors on the HOMO/LUMO energy levels, the optical energy gap and the interactions between TCE’s and C60. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Our structure confirms the composition of the catalytic pocket of the enzyme. We describe the homo-dimeric state of the protein that we observed in the crystal and in solution. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Until now, comprehensive fascicular atlases have been created for humans (Homo sapiens), rhesus macaques (Macaca mulatta), and several other nonhuman primate species, but never in a nonhuman ape. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Direct excitation of tetracene lead to fast energy transfer to pentacene and subsequent singlet fission, which prevented homo‐ or heterofission of a singlet exciton on tetracene.…”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…The derivations in this work are for symmetric dimers but are expected to have general applicability for homo-oligomers.…”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Moreover, it was revealed that the interaction of the [ScPc](+1) and [TiPc](0) complexes with the CH(2)O molecule was stronger, in which the highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) energy gap of 46% and 36% decreased after FA adsorption. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…This assumption is supported by TD‐DFT calculations, which show a significant contribution from Si−Si bonds to the HOMO of the molecule.…”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…We mentioned the preparation of vegetable oil-based homo- and copolymers and their characterization by different spectral techniques (FTIR/NMR). …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Due to serious concerns regarding potential toxicity of poly(N-isopropylacrylamide) (PNIPAm), design of alternative homo- and copolymer gels with controllable swelling properties has recently become a hot topic. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…N-Oxidation has been found to affect the electronic band gap through increase of the HOMO and lowering of the LUMO. Furthermore, exceptionally strong intramolecular S–O chalcogen bonding interactions in the bithiazole core contribute to rigidification of the conjugated system. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…We have found that pnictogen bonds have a significant covalent character stemming from strong HOMO–LUMO interactions between the lone pair of A(−) and σ* of D(3)Pn. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Two major empirical themes emerge: attraction to and consumption of fermenting fruits (and nectar) by numerous vertebrates and invertebrates (e.g., Drosophila flies), and genomic evidence for natural selection consistent with sustained exposure to dietary ethanol in diverse taxa (including hominids and the genus Homo) over tens of millions of years. We also describe our current field studies in Uganda of ethanol content within fruits consumed by free-ranging chimpanzees, which suggest chronic low-level exposure to this psychoactive molecule in our closest living relatives.…”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Additionally, Molecular electrostatic potential (MEP) and HOMO-LUMO are reported. Multi wavefunction analysis like ELF (Electron Localization Function) and LOL (Localized Orbital Locator) are analyzed. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Many of us had refresher courses in virology, immunology, and epidemiology in 2020, and we were reminded of the fact that Homo sapiens, the wiliest predator on the planet, has been hunting everything that moves for millennia. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…The absorption and fluorescence properties of the obtained products were investigated and their HOMO/LUMO energy levels were estimated by cyclic voltammetry measurements. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Hemocyanin from horseshoe crab in its active form is a homo-hexameric protein. It exists in open and closed conformations when transitioning between deoxygenated and oxygenated states. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…We report here that specific Ig-like repeats from the extracellular domains of neuronal Cell Adhesion Molecules share a highly conserved Neurite Outgrowth and Guidance (NOG) motif, which mediates homo- and heterophilic interactions crucial in neural development and repair. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…The behavior of the 1-arylated 7-azaindoles in direct iodination was then studied, and the results explained by considering the HOMO orbital coefficients and the atomic charges. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…The mechanism of this photo-initiation most likely relies on an electron transfer from the borate salt into the semi-occupied HOMO of the excited dye molecule Safranine O, which after fragmentation generates an initiating alkyl radical and longer-lived dye radical species. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso

“…Homo sapiens, as well as other primates, developed the evolutionary advantage of storing excess energy as body fat, primarily in the readily accessible visceral fat compartment when food is plentiful for use during scarcity. …”
Enlace del recurso
Enlace del recurso
Enlace del recurso