ライフサイエンスコーパス: delocalization

1 al Raman fingerprint of through-space charge delocalization.

2 tless, and thus are devoid of sample product delocalization.

3 iencing or not the nN --> sigma*N-H electron delocalization.

4 g on whether they enhance or weaken aromatic delocalization.

5 rexpression of CIZ1 likewise results in Xist delocalization.

6 ue iron environment and thus strong electron delocalization.

7 binding of the CT state arising from charge delocalization.

8 resonance structures that contribute to spin-delocalization.

9 o be aromatic systems with varying degree of delocalization.

10 of the CH ortho to B leads to smaller cyclic delocalization.

11 trom, indicating virtually complete electron delocalization.

12 nt in detection limits and decreased analyte delocalization.

13 conceptually described by 1-dimensional (1D) delocalization.

14 cal aromatic units, peripheral, and all-bond delocalization.

15 ultiporphyrin arrays that feature vast areal delocalization.

16 ing with bond lengths indicating significant delocalization.

17 irection demonstrates significant electronic delocalization.

18 how no change in the extent of triplet state delocalization.

19 roscopy demonstrates extensive excited-state delocalization.

20 ion potentials, and pi* orbital energies and delocalization.

21 eneration efficiency, independent of exciton delocalization.

22 d isomerase (KSI) facilitates quantum proton delocalization.

23 ed by the bridging urazoyl ring and benzylic delocalization.

24 on, leading to increased cell width and MreB delocalization.

25 , Ni, Ru, Fe), regardless of their degree of delocalization.

26 omatin upon mrg-1 knockdown, coincident with delocalization.

27 ongeminate recombination by effective charge delocalization.

28 activity to analogous systems with lower pai-delocalization (2(2-) and 3(2-)).

29 NHE is in part attributed to complete charge delocalization across both Ir centers.

30 MO-LUMO gap was observed due to efficient pi-delocalization across the phosphaviologen core, as well

31 ide sample slide that minimizes visceral fat delocalization after thaw-mounting of tissue sections.

32 CBM blend in terms of morphology and exciton delocalization allow excellent charge generation in all

33 This result can be explained by a charge delocalization along a well-stacked domain in the strand

34 relaxation studies suggest a strong electron delocalization along the longitudinal axis of the column

35 r backbone, potentially enhancing electronic delocalization along the main-chain.

36 mena associated with an extended pi-electron delocalization along the polymer backbone.

37 The inherent connection between (spatial) delocalization and (energetic) resonance stabilization e

38 havior, whereby 1 displays strong electronic delocalization and 2 can be observed in unprecedented va

39 modes provide an accurate description of pi-delocalization and an accurate AI.

40 linked COFs display only a moderate electron delocalization and are susceptible to hydrolysis, partic

41 ty-that is characterized by the extent of EE delocalization and diffusion.

42 d-retinal barrier (BRB) permeability through delocalization and down-regulation of the AQP4 and Kir4.

43 relationship between orbital localization or delocalization and electronic coupling in molecular junc

44 tween HCOO(-) and H2SO4 through the electron delocalization and formation of two strong hydrogen bond

45 ociation by comparing the effects of exciton delocalization and impure domains on the photo-dynamics.

46 Lipid delocalization and ion suppression are two major effects

47 such as degree of 5 f-electron localization/delocalization and its relationship to magneto-vibration

48 iginate from differing conditions of exciton delocalization and localization realized in the mutant.

49 polymer film, leading to large wavefunction delocalization and low site energies.

50 ignificant triacylglyceride and phospholipid delocalization and major ion suppression effects.

51 cued RGP death and microcephaly, but not RGP delocalization and randomized mitotic spindle orientatio

52 ation, is used as a measure of the degree of delocalization and relates to the effects of chain lengt

53 g explicit treatment of excess proton charge delocalization and shuttling through the His37 tetrad.

54 Further, we evaluated potential delocalization and signal loss of other tissue lipids an

55 find a synergistic relationship between spin delocalization and spin polarization mechanisms and that

56 The valence orbitals showed extreme delocalization and strong pai-interactions between the t

57 importance of state accessibility and charge delocalization and suggest that energetic offsets betwee

58 e molecular structure will affect its charge delocalization and the binding energy with the correspon

59 However, proton delocalization and the overall diffusion process are not

60 rties of the aggregate, modulating the redox delocalization and the persistence of the intracore coup

61 ic shift to the near-IR region, greater spin delocalization, and anodic shift of the reduction potent

62 of nuclear quantum effects, such as nuclear delocalization, anharmonicity, zero-point energy, and tu

63 xes with dithiolene ligands without extended delocalization are Class II mixed-valent compounds in th

64 The patterns of global pi-electron delocalization are described in graph theory terminology

65 rs from a well-known over-emphasis on charge delocalization arising from self-interaction error that

66 e induced magnetic field shows a significant delocalization around the three-membered rings.

67 f the interaction, and three-center electron delocalization as in ozone.

68 e of antiaromaticity, and increase in charge delocalization assist in the additional dehydrogenative

69 ed R735X-infected mice displayed connexin 43 delocalization at intercardiomyocyte gap junctions, a ch

70 ions being dominated by n --> sigma* orbital delocalization between a lone pair (n) of a (thio)amide

71 This new orbital model considers electronic delocalization between pyramidal diradical resonance str

72 size owing to enhanced intraparticle charge delocalization between the particle-bound ferrocenyl moi

73 ation pathways and (2) H(+) exchange between delocalization bodies (DBs) at binding sites at the inte

74 ions that increase cyclic 4n + 2 pi-electron delocalization boost aromaticity.

75 The model incorporates the effects of pi delocalization, cage strain, and steric hindrance.

76 e data, calculations show that electron-hole delocalization can actually oppose Co(IV) formation.

77 rate estimate of the extent of triplet state delocalization can be obtained from the hyperfine coupli

78 te that the redox series exhibits electronic delocalization (class II-III), yet no intervalence charg

79 We present evidence that exciton delocalization, coincident with an increased relative ad

80 This delocalization comes from the large energy gap between t

81 ecifically, lithium leads to enhanced proton delocalization compared with sodium.

82 tron-hole dissociation intermediated by hole delocalization (conformationally assisted and thermally

83 Electronic delocalization consequently occurs through nonadiabatic

84 This excited-state delocalization contrasts with previously reported cages.

85 rk demonstrating the electron wave functions delocalization dependent ultrasensitive LSPR properties

86 e alternative mechanism of n --> pi* orbital delocalization does not seem to play a significant role

87 This delocalization dramatically stabilizes the deprotonation

88 designed pai-system provides a superior spin-delocalization effect and a large steric effect, mostly

89 e the importance of often-overlooked orbital delocalization effects in conformational control and mol

90 sodium terephthalate which improves electron delocalization, electrical conductivity and sodium uptak

91 orbital is demonstrated by NBO second-order delocalization energies, Fock matrix deletions, and natu

92 Although an increasing degree of electron delocalization for elements down a column of the periodi

93 m hTR in mitotic cells coincident with TCAB1 delocalization from Cajal bodies.

94 primary cilia, causing its inactivation and delocalization from cilia.

95 We identified 2 pathways of hemoglobin delocalization from CSF into the brain parenchyma and in

96 nation of large magnetic anisotropy and spin-delocalization from metal to ligand which induces import

97 ng on a variety of cluster properties (redox delocalization, ground-state stabilization, and breadth

98 ), and harmonic oscillator model of electron delocalization (HOMED) analyses, of quantum mechanics (Q

99 rstood in terms of pressure-induced electron delocalization; however, the governing mechanisms are co

100 f through-bond and through space pi-electron delocalization (i.e., pi-conjugations).

101 n one way or another-as indirect measures of delocalization, i.e., resonance stabilization, of the re

102 rgy, but transfer by a non-activated quantum delocalization, if the NP energies are closer than the o

103 The AI turns out to describe pi-delocalization in a balanced way by correctly describing

104 t quantitatively determines the degree of pi-delocalization in a cyclic conjugated system.

105 nctional theory calculations, showing uneven delocalization in a porphyrin dimer in which a terminal

106 adicals, again due to more efficient radical delocalization in allyl radicals.

107 e first evidence for extensive triplet state delocalization in an artificial supramolecular assembly

108 e investigated this effect by analyzing spin-delocalization in benzo[cd]-triangulene, a spin 1/2 grap

109 The significance of vacancy delocalization in decreasing the vacancy segregation ene

110 ize the competition between localization and delocalization in ensuring efficient charge separation.

111 ination sphere, 2) M-M bonding, and 3) redox delocalization in formally mixed-valent species.

112 teractions provide a route to enhance charge delocalization in fullerenes and other organic semicondu

113 mation (backbone dihedral angle) on electron delocalization in infinite saturated regular helices [(C

114 ence of electronic symmetry on triplet state delocalization in linear zinc porphyrin oligomers is exp

115 Redox delocalization in mixed-valent 3 was explored with cycli

116 ast, at the 2D semiconductor heterojunction, delocalization in momentum space due to strong exciton b

117 lecular donor/acceptor interface, electronic delocalization in real space can dictate charge carrier

118 Electronic delocalization in redox-active polymers may be disrupted

119 ent their thermodynamic stabilities and spin delocalization in solvents of varying polarity.

120 ) motivated us to assess the role of exciton delocalization in the activation of this process.

121 work, giving rise to extended quantum proton delocalization in the active site.

122 The extent of isotropic shielding delocalization in the contour plots in planes 1 A above

123 ap) = 0 deg) stem from nonclassical electron delocalization in the former and the lack thereof in the

124 form a pyridinium cation induces electronic delocalization in the PLP, which correlates with the enh

125 The origin of valence delocalization in thioredoxin-like ferredoxin Cys-to-Ser

126 ry operations-namely, through-space electron delocalization in triangular macrocyclic molecules that

127 both "intermolecular" excitation and charge delocalizations in [2.2]paracyclophane molecules is show

128 ies typical of metallic bonding and a larger delocalization index (bond order) for the less polar U-N

129 (bond critical point electron densities and delocalization indices) and the average Ac-He distances,

130 The magnitude of exciton delocalization induced by the NHC (after scaling for sur

131 tropositive alkyl substituents and by charge delocalization into additional rings.

132 r(*) are ferromagnetically coupled due their delocalization into orthogonal magnetic orbitals on the

133 84 kcal/mol), consistent with iminyl radical delocalization into the aryl substituent in 2 as compare

134 ntification of a significant charge and spin delocalization involving both the phenyl ring and the su

135 an also stabilize a benzylic radical by spin delocalization involving silver.

136 As a consequence, this delocalization is accompanied by a decrease in H3K27me3

137 au deloc < 400 as, whereas interlayer charge delocalization is dynamically quenched in excess of a fa

138 The extent of triplet state delocalization is investigated in rigid linear zinc porp

139 r deprotonation, an increase in the electron delocalization is observed.

140 varying phenyl units and reveal that orbital delocalization is responsible for both decreasing reorga

141 ximately 300 K) and a high degree of valence delocalization (Kc = 10(2)-10(8)) with observable IVCT b

142 rrects it in those cases where peripheral pi-delocalization leads to higher stability.

143 irect measure of the (6,5) SWNT hole polaron delocalization length (2.75 nm); (iii) determine steady-

144 t study thus not only determines the polaron delocalization length in PTB7 but also validates the app

145 rameter D can lead to underestimation of the delocalization length, unless combined with quantum chem

146 nique class of isoenergetic wires where hole delocalization mainly occurs via dynamic hopping and thu

147 pe biradical intermediate is stabilized by a delocalization mechanism, where spin is delocalized onto

148 ps all stabilize benzylic radicals by a spin delocalization mechanism.

149 sm can coexist prior to the full 3d-electron delocalization (Mott-Hubbard d-d breakdown) at pressures

150 o accept and release Na(+) ions via a charge-delocalization network.

151 ld demonstrate that they arise from n-sigma* delocalization, not from an inductive effect.

152 if any, energetic stabilization from global delocalization, obviating the need for the concept of su

153 Local and global pi-electron delocalization occurring in planar poly-1,7-[N]calicenes

154 ty within the Mn-oxo unit, with the greatest delocalization occurring within the Mn(V)-oxo species (0

155 BO) calculations support the role of orbital delocalization (occurring by intramolecular chalcogen bo

156 experimental and computational evidence for delocalization of 5f electrons in the mixed-valent Pu(II

157 nalysis and computational studies revealed a delocalization of 6pi-electrons over the BC2N2 five-memb

158 oups have quite a different effect on the pi-delocalization of a conjugate system when bonded at orth

159 ity in sampling area, spatial precision, and delocalization of analytes in tissue induced by LESA wer

160 ts in the resulting MSI experiment including delocalization of analytes, altered adduct profiles, and

161 clear due to the complexity arising from the delocalization of bonding, and nonbonding, electrons.

162 character is markedly enhanced by efficient delocalization of cationic charge density into the five-

163 The delocalization of cationic charges in the biguanide grou

164 ange order (MRO) mediated by the 4f electron delocalization of Ce under pressure.

165 at the charge on the copper-bound carbon and delocalization of charge onto the aryl ring control the

166 in-4, the paracellular chloride channel, and delocalization of claudin-4 from the tight junction.

167 ese peak red shifts are a consequence of the delocalization of confined exciton wave functions into t

168 nhibiting gap junctions increased SMC death; delocalization of cytochrome C activated caspases 9 and

169 agation by inducing phase transformation and delocalization of deformation around the crack tip.

170 d [Mn@Pb12](3-) and is a result of extensive delocalization of electron density from the transition-m

171 e small non-radiative voltage loss, and (ii) delocalization of electron wavefunctions at donor/accept

172 Localization and delocalization of electrons is a key concept in chemistr

173 ble to form charge-transfer orbitals through delocalization of electrons near the Fermi energy level.

174 Spectroscopic data indicate considerable delocalization of excitations along the pi-stacked colum

175 excited-state populations, and localization/delocalization of excitations.

176 Delocalization of excitons within semiconductor quantum

177 es of these structures, suggesting extensive delocalization of injected electrons, analogous to fulle

178 distribute diffusely results in the striking delocalization of KaiC.

179 nistically to cause the aberrant cytoplasmic delocalization of NPM1 mutants.

180 translocate to the nucleus, possibly due to delocalization of nuclear pore complexes (NPCs) at the n

181 Moreover, the delocalization of odd electrons in these radicals has be

182 As such, maximization of the electronic delocalization of pai-orbitals of GQDs with Fe(3+) leads

183 We show that RNase H1-dependent delocalization of paraspeckle proteins to nucleoli is an

184 eport a new transduction mechanism involving delocalization of photoexcited conduction electrons wave

185 duction in binding affinity results from the delocalization of PI(4,5)P2 in the binding pocket.

186 9)Si NMR analysis of this complex pointed to delocalization of positive charge onto both the beta-sil

187 olerate both partial depletion of RanGAP and delocalization of RanGAP from the nuclear envelope.

188 oss of this interaction results in premature delocalization of Rga1 from the immediately preceding di

189 f Cdc42 polarization predicts that premature delocalization of Rga1 leads to more frequent Cdc42 repo

190 r and a new bud site is established prior to delocalization of Rga1.

191 strate that ultimate lateral confinement and delocalization of surface plasmon modes are simultaneous

192 the ectodomain/TMD interface, including the delocalization of the converging helix and rearrangement

193 We demonstrate that delocalization of the doublon is a necessary condition f

194 hese are investigated as a function of T, pi delocalization of the electron density within R, and the

195 with the attachment of ligands that allow pi delocalization of the electron density.

196 Stokes shift as a direct consequence of the delocalization of the electron wavefunction over the ent

197 Explanations capitalizing on either the delocalization of the endocyclic oxygen lone pair into t

198 pendencies, as well as signatures of spatial delocalization of the excited states which are character

199 DFT calculations predict that the delocalization of the frontier molecular orbitals should

200 result is supported by the finding of strong delocalization of the highest occupied molecular orbital

201 t to NDI when excited at 370 nm, followed by delocalization of the hole over the T(4) segment.

202 low polarity medium, may reflect interchain delocalization of the hole.

203 xperiments, X-band ENDOR and HYSCORE, reveal delocalization of the iron-based spin onto the alpha-car

204 ion mode, and suggest that a balance of spin delocalization of the isolated radical as well as attrac

205 Significant delocalization of the molecular orbitals along the bridg

206 avier homologues are, in part, stabilized by delocalization of the N lone pairs into the vacant p-orb

207 In addition, the delocalization of the neutral triplet exciton was also d

208 ses substantially, which correlates with the delocalization of the oxygen electron to the benzene rin

209 nventional ones is attributed to the partial delocalization of the pai-electrons within the hydrogen

210 The delocalization of the photoexcited triplet state in a li

211 e antiaromatic stacking furthermore allows a delocalization of the pi-electrons, which enhances the t

212 of chromophores and affected the conjugative delocalization of the pi-electrons, which produced short

213 These potential shifts suggest that the delocalization of the positive charge on the side arm ov

214 Sufficient delocalization of the positive polaron in organic photov

215 the high-performance PTB7 polymer revealed a delocalization of the positive polaron in the polymer ov

216 ca. 100 mV, and the arrays show evidence for delocalization of the radical cation over both porphyrin

217 R spectroscopy and DFT calculations verified delocalization of the radical over the extended pi-syste

218 ion of proteins to proceed with undetectable delocalization of the resulting products from their prec

219 lipids' peroxidation and is initiated by the delocalization of the targeted double bonds in the tails

220 These data unequivocally prove the delocalization of the triplet state over both porphyrin

221 The spatial delocalization of the triplet state wave function in sys

222 n paramagnetic resonance spectrum revealed a delocalization of the unpaired electron through the thio

223 pecies, and determine the extent of electron delocalization of the unpaired spins over the radical an

224 The Blatter derivative features a peculiar delocalization of the unpaired-electron orbital over som

225 d orbital calculations suggest covalency and delocalization of the uranium f(2) electrons with the ca

226 A theoretical quantum model confirms the delocalization of the wavefunctions of the hybridized st

227 Delocalization of these proteins presumably is a key rea

228 s, we demonstrate its efficacy in minimizing delocalization of triacylglycerides, the primary constit

229 Delocalization of Ulp1 causes DNA damage and cell cycle

230 diffraction and IR spectroscopy reveal that delocalization of unpaired electron density into the cya

231 or the terminal adduct featuring substantial delocalization of unpaired spin onto the N2 ligand.

232 sodium cations have different effects on the delocalization of water protons donating a hydrogen bond

233 ) and the electronic structure (pai-electron delocalization) of the constituent molecules.

234 bonding interactions and, because of 6psigma delocalization, of Pt-P bonds in the course of the two r

235 at are challenging to analyze because of fat delocalization on and off section leading to significant

236 Here we investigate the effects of anion delocalization on electron transfer using zinc meso-tetr

237 orates the enhancing effect of excited state delocalization on individual rates of energy transfer as

238 with significant spin density on Ni and some delocalization on S and Fe.

239 been used to explore the effects of exciton delocalization on singlet fission (SF).

240 ne hand and quantum indistinguishability and delocalization on the other hand is characterized by a s

241 ing hyperfine couplings associated with spin delocalization onto the electron-accepting ligands in th

242 alized vibrational wavepacket which triggers delocalization onto two charge transfer states after pro

243 rporating either the computed degree of spin delocalization or the radical polarizability as well as

244 dification leading to protein degradation or delocalization, or altering protein activity.

245 nine (G) runs in double-stranded DNA support delocalization over 4-5 guanine bases.

246 e, we examine the prospect of extending spin-delocalization over a helical backbone in a model compou

247 le stabilization switches over from (static) delocalization over both aryl rings to (dynamic) hopping

248 tapes) exhibit extended conjugation and even delocalization over more than two porphyrin macrocycles,

249 t to the monomeric unit, indicating complete delocalization over six porphyrin units in this symmetri

250 he planarization, i.e., elongation of the pi-delocalization over the benzo[a,c]phenazines moiety.

251 rely empty, leading to an extensive electron delocalization over the cube and significant stabilizati

252 rise from the hybrid nature of wave function delocalization over the linear and radial contributors i

253 e complex was synthesized, in which electron delocalization over the nanographene and the metal ion s

254 fluorene pai-system, with significantly less delocalization over the NHC ligand.

255 nits evidences the less efficient electronic delocalization over the phenyl ends as the oligophenylen

256 ene (B2) gives rise to anions with extensive delocalization over the pyrenylene bridge and between th

257 he question of core-hole localization versus delocalization over two equivalent atoms has long been d

258 nit, whereas previous work demonstrated even delocalization over two units in meso-to-meso ethyne or

259 ated that the system favors a 22pai electron delocalization pathway that runs through the fused benzo

260 ristics by virtue of a 17-atom 18pi electron delocalization pathway.

261 t the dications favor 23-atom 22pai electron delocalization pathways.

262 he monomer-monomer electronic interactions), delocalization persists.

263 n, and (iv) exotic long-bonding and metallic delocalization phenomena, where no single "parent" Lewis

264 er (IVCT) occurs, dependent on the degree of delocalization, places these within class II or III of t

265 This consists of charge delocalization promoted by easy access to different elec

266 the molecule a good emitter, and the charge delocalization properties leading to excimer formation m

267 Recently, it has been proposed that exciton delocalization reduces the exciton binding energy and pr

268 the two mechanisms produces three different delocalization regimes as a function of the backbone dih

269 s acidity in addition to enhanced electronic delocalization relative to benzo-fused analogues.

270 clusters exhibiting fast electron hopping or delocalization remains challenging, because intermetalli

271 d experimentally that complete triplet state delocalization requires the chemical equivalence of all

272 ing several oxidative equivalents via charge delocalization, resulting in a highly reactive oxidized

273 relaxes in energy to produce CT states with delocalization sizes in the range of 1-3 nm.

274 heights are related to the magnitude of the delocalization stabilization of each fully conjugated sy

275 y is of greater importance for triplet state delocalization than other frequently invoked factors suc

276 with the graphene sheets provide further pi-delocalization that improves the catalytic performance o

277 morphous Ce-Al alloy is not due to the Ce 4f delocalization that is expected to bring the size of Ce

278 duces a novel type of electron solvation and delocalization that is fundamentally different from eith

279 R) often exhibit a high degree of electronic delocalization that serves to minimize overpotential and

280 of m-phenylene units interrupting the global delocalization, the presence of bithiophene units in di-

281 -vis, and CD spectroscopies, validating spin-delocalization through a chiral backbone, in accord with

282 iety enables protonation control of electron delocalization through the 2D COF sheets.

283 Furthermore, charge delocalization through the [2.2]paracyclophane in the ne

284 es of the cages, arising from the electronic delocalization through the metal centers.

285 S2 exhibits spin-dependent attosecond charge delocalization times (tau deloc) for carriers confined w

286 unequivocally support that a crossover from delocalization to hopping occurs at a unique dihedral an

287 TMEM43-S358L shows partial delocalization to the cytoplasm, reduced interaction wit

288 sahedron, which might link to Yb 4f electron delocalization upon compression, and match the result of

289 asing the degree of coherence, i.e., exciton delocalization, via supramolecular architectures enhance

290 ovian line shape theory and includes exciton delocalization, vibrational sidebands, and lifetime broa

291 ates intramolecular through-space electronic delocalization when the PDI-helicene is reduced.

292 y on lactone acidification through lone-pair delocalization, which leads to extremely rapid intermole

293 o-bridged picenophane shows the weak exciton delocalization while the cis-ethylene-bridged picenophan

294 ,4-azaborine does not change much its cyclic delocalization, while replacement of the CH ortho to B l

295 y hampered, zwitterionic states and electron delocalization with quinoidal features are promoted as a

296 series reveals the highest degree of valence delocalization with the most intense IVCT bands (Kc = 10

297 the N=P(V) double bond and its potential for delocalization within a cyclic pi-electron system.

298 e with surface area is attributed to exciton delocalization within each structure, which we show via

299 nd correspondingly high degree of excitation delocalization within the Chls a610-a611-a612 cluster da

300 This implies a rather high degree of sigma-delocalization within the hydrocarbons, not too dissimil