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1 nd these are related, both geometrically and energetically.
3 glycosidic linkage fundamentally alters the energetically accessible conformational space of a thiom
4 omputational methodology to predict multiple energetically accessible conformations for G protein-cou
6 times, enabled by the combination of vacant, energetically accessible heterocycle-based acceptor orbi
7 s reported in the literature are shown to be energetically accessible in the enzyme-substrate complex
8 omerization of {[LCu(III)]2-(mu-O)2}(2+) are energetically accessible pathways for O-O bond formation
9 ab initio calculations cannot identify any (energetically accessible) crossing points between the re
10 t behave well unless the axial conformer was energetically accessible, which is consistent with the t
15 these inter-Landau-level states, being both energetically and spatially isolated quantum states, are
17 ects of palmitate and glucose on resting and energetically challenged mitochondria in DRG neurons.
19 ER) stress and unfolded protein response are energetically challenging under nutrient stress conditio
21 ciples calculations, showing these polytypes energetically comparable to the A7 structure under ambie
22 itio random structure search reveals all the energetically competitive monolayer configurations to be
24 Here, we examine these interactions in a bio-energetically constrained, spatially and temporally reso
26 ed response appears to divert resources from energetically costly biomass production to improve resil
28 e ecosystems, where consumers must cope with energetically costly changes in CO(2) -driven carbonate
29 by trade-offs in resource allocation between energetically costly immunity and competing processes su
33 whether virulence factor expression is truly energetically costly within host tissues and whether exp
35 iables, if earlier, longer calling bouts are energetically costly, and therefore limited by overnight
37 Pregnancy is characterized by extensive, energetically-costly changes across numerous physiologic
38 ences, we built a model of residues that are energetically coupled and that define molecular routes f
39 rwise mutations reveals that alphaAsp-138 is energetically coupled to alphaArg-209 in the neighboring
41 e arm contains four antiporter-like domains, energetically coupled to the quinone site and involved i
44 th the GH loop, rather than the DE loop, are energetically critical and define the m4-1BB receptor se
46 ric DTE chromophore quickly converts between energetically degenerate P and M helical conformations.
48 artitioning of PbTiO3 thin films into nearly energetically degenerate, hierarchical domain architectu
49 rt inter-birth intervals that make offspring energetically demanding [9] and have moved to a dietary
50 -deficient ECs is severely compromised under energetically demanding conditions, as revealed by signi
55 le in increased fat metabolism during highly energetically demanding periods, and that blubber concen
57 thesis of eukaryotic ribosomes is a complex, energetically demanding process requiring the aid of num
58 strocytes ensure local metabolic support for energetically demanding processes and enable coupling be
59 nse and reproduction are physiologically and energetically demanding processes and have been observed
60 daptive response featuring the inhibition of energetically demanding processes, including gluconeogen
62 nformation in the unpaired nucleotide to the energetically disfavored anti conformation required for
63 , carbon, but the mechanistic basis for this energetically disfavored regiostereochemistry has been l
64 chain of p-biphenylalanine is trapped in the energetically disfavored, coplanar conformation of the T
65 ker displacement during formate formation is energetically disfavored, in line with the excellent cat
66 ounts for the charge transport physics in an energetically disordered DOS and the Franck-Condon broad
67 t c intermediates and pathways during normal energetically downhill kinetic folding, the present work
72 ke enzyme for reductive choline formation is energetically efficient compared with known pathways.
73 ttoral water temperatures reduces the use of energetically efficient habitats culminating in decrease
74 r sense, we have discovered a temporally and energetically efficient mechanism in which the innate im
75 this theory for designing and understanding energetically efficient nonequilibrium processes through
78 f the core states by a transiting carrier is energetically enabled, resulting in a sequential tunnell
84 trategy by modulating taking-off, their most energetically expensive behaviour, to favourable wind co
85 ng, development, and plasticity, but is more energetically expensive compared with the jammed phase,
86 conserved mechanism well-suited to suppress energetically expensive correlated network events under
88 magnets suffer several drawbacks, including energetically expensive fabrication, limited availabilit
89 , the amino acid histidine is among the most energetically expensive for bacteria to synthesize; ther
92 ary carbon and energy substrate, whereas the energetically expensive NMG pathway plays a pivotal role
96 on or Na(+) motive force and are, thus, less energetically expensive than the majority of other dicar
102 than for the Ag 4d(10) orbitals, Cu(I) atoms energetically favor 4-fold coordination, forming [CuX4 ]
103 to generate molecular conformations that are energetically favorable and more likely to be observed e
106 t pools to generate hundreds of thousands of energetically favorable binding sites for a target ligan
108 ecular oxidation of the phenol by Ru(III) is energetically favorable by both stepwise and concerted p
110 oxidized to phosphate (PO4(3-)), is the most energetically favorable chemotrophic electron-donating p
111 otides inside a CA hexamer cavity results in energetically favorable conditions for passive transloca
112 t in the case of the six-membered lactone an energetically favorable conformer adopts a nearly synper
113 n active site could lead to structurally and energetically favorable coordination ready for the non-t
118 entially layered manner, thereby creating an energetically favorable gradient for charge separation.
119 olding into wild-type-like structures remain energetically favorable in cohesin-depleted cells, poten
120 h aspect ratio, electrically addressable and energetically favorable interfaces, and substantial enha
121 als, since an unoccupied d-shell provides an energetically favorable location for the electrons to oc
124 to the tetragonal superlattice that becomes energetically favorable over its hexagonal counterpart.
125 ar spatial distributions of organics with an energetically favorable packing density that agrees with
126 thm is applied to search for the most common energetically favorable packing motifs in crystalline st
129 drophobic channel and observed that the most energetically favorable pose includes a TPN orientation
130 This leads to the emergence of a new type of energetically favorable quasiparticle: bielectron vortic
133 s prepared by direct synthesis, are the most energetically favorable sites for reaction pathways lead
134 of pairs in dinucleotide steps, arising from energetically favorable stacking of the nitro group in w
135 ar concerted cycloaddition mechanism via the energetically favorable syn/endo-transition states.
136 rt against its concentration gradient to the energetically favorable transport of one or several ions
137 -pathway self-polymerization that results in energetically favorable trimers and could serve as a dri
138 experiments and DFT calculations support an energetically favorable type 1 cubane formation pathway
139 onstrates that voltage sensor return is less energetically favorable upon repolarization than pore ga
141 ce small lattice strain via the formation of energetically favorable {112}beta1/{100}Mg interfaces, a
143 tition function calculation to only the most energetically favorable, effectively reducing runtime wh
144 Li and Na ions along the zigzag direction is energetically favorable, while Li/Na diffusion long the
152 hase separation and reconstruction, which is energetically favored compared to local rearrangements w
156 the oxidative sorption of ferrous iron is an energetically favored process at several edge surfaces o
158 y oxygenate primary C-H bonds over adjacent, energetically favored secondary C-H bonds, but the mecha
159 regular, polygonal-shaped tessellation is an energetically favored solution because it minimizes tota
160 g revealed that Pt NP growth is sufficiently energetically favored to enable displacement of linkers
161 entrations within hours of incubation and is energetically favored, in contrast to classical domain-s
163 boosted catalytic performance stems from the energetically favourable adsorption of reaction intermed
165 ion of domain walls in ferroelectrics is not energetically favourable in low-dimensional systems.
166 that permeation by dicationic pentamidine is energetically favourable in TbAQP2, driven by the membra
169 performed to determine the structures' most energetically favourable, biologically accessible motion
173 e transfer from nanocrystals to tetracene is energetically favoured, and hence triplet transfer proce
174 s demonstrate that this C-C bond cleavage is energetically feasible and thermodynamically favored thr
176 calculations performed in order to evaluate energetically feasible reaction pathways revealed the in
177 with quantum chemical calculations to reveal energetically feasible synthetic disconnections, minimiz
178 n of a (4 + 3) cycloaddition product was not energetically feasible, but (3 + 2) cycloaddition produc
181 etermined by MD for ring configurations with energetically flat pseudorotational itineraries may not
182 and sequences of quantum states split away, energetically, from the degenerate bulk Landau levels.
183 nstrate that the contact line (CL) motion on energetically heterogeneous solid surfaces occurs in a c
184 motif of an apical silicon(II) atom with an energetically high lying lone pair of electrons that is
186 etween high-energy excited states, producing energetically hot states (>6.0 eV) that lead to molecula
187 s along the GammaK directions shift downward energetically in the presence of interlayer interactions
188 ysis of the uncatalyzed reaction predicts an energetically inaccessible iminium intermediate, and a l
189 nd breaking would produce protonated CO2, an energetically inaccessible species that can be avoided b
190 of common organic functional groups that are energetically inaccessible using traditional HAT-based a
191 nal search and compaction electrostatics are energetically independent from the formation of the tert
192 s has been puzzling since fixing nitrogen is energetically inefficient compared with using available
197 s occurs through a zero-energy state that is energetically isolated from a continuum, yielding unifor
198 onding facilitates alkyne slippage, which is energetically less costly for gold than for platinum and
202 s predict the hydrogen bonds to oxygen to be energetically less favored; however, their considerable
207 Among the possible reaction pathways, the energetically low-lying reaction channel involves an int
213 tion like icefishes, pre-mating barriers are energetically more efficient than post-mating barriers t
214 thin limit above which the wurtzite phase is energetically more favorable according to the theoretica
215 he inter-atomic bonding contributions become energetically more favorable in that order for both C(2)
216 ed to be endothermic by 169 kJ/mol, which is energetically more favorable than formation of NUOCl2(-)
217 demonstrate that MOR on smaller PtZn iNPs is energetically more favorable than larger iNPs, due to th
218 CN states having a narrower distribution are energetically more favorable toward the WGD transition.
219 oxygen vacancies through making the reaction energetically more favorable via applying interfacial st
220 nism via an unstable Cu(III) intermediate is energetically more feasible than other possible mechanis
221 carbonate/sodium biphosphate) is found to be energetically more preferred over the analogous base-fre
224 at the branched head-to-tail vinyl cation is energetically more stable than the corresponding linear
226 articles to reach regions in space which are energetically not accessible according to classical mech
229 conclusions: (1) symmetry is not necessarily energetically optimal in constrained human walking, and
230 metries to determine whether symmetry is the energetically optimal strategy for walking on a split-be
231 that asymmetric gait may be adopted if it is energetically optimal under certain biomechanical and ne
233 omic coordinates of this model we defined an energetically optimized K-PHI structure, in which the K
234 s binding to a MOR crystal structure suggest energetically preferred binding modes that differ from c
235 ations confirm that the quasi-AB stacking is energetically preferred over the AA stacking in solvated
236 ion, an eta(3) -allyl configuration on Mg is energetically preferred over the eta(1) - (sigma-bonded)
237 mmetry stabilized by pressure is found to be energetically preferred over the experimental NaCl-type
240 nd formation energies, the MnOh2+ polaron is energetically preferred to the FeOh2+ polaron, resulting
242 ate) ligands causes the larger species to be energetically preferred, we are able to freeze the self-
243 t cluster consisting of few than three atoms energetically prefers a face-centered-cubic stacking, to
244 -bipyridine-5,5'-dicarboxylate linker; it is energetically prohibitive for it to adopt the twisted co
248 at Bacteroides species are metabolically and energetically robust and do not mount stress responses i
250 ed this observation and identified a second, energetically similar but conformationally distinct bind
251 fail when two or more potential products are energetically similar, but rational structural perturbat
252 the substrate-enolate, which is accessed via energetically small, escalating steps in which the groun
253 dation via the Psigma* pathway represents an energetically somewhat higher lying alternative; possibl
256 ds through a triplet intermediate to form an energetically stable four-membered ring in the singlet s
257 nd then refold the trimeric assembly into an energetically stable post-fusion state, a process that d
258 culations show that all three clathrates are energetically stable with relaxed lattice constants matc
260 Via 'phosphate steering', basic residues energetically steer an inverted ss 5'-flap through a gat
261 ur results suggest that the CD site is in an energetically strained configuration, and this helps dri
262 r food restricted (manipulations intended to energetically stress larvae) adopted a less twig-like po
263 etecting productive fruit patches during the energetically stressful dry season also benefits dichrom
264 tions revealed a distinct transition between energetically sustainable and unsustainable ATP concentr
265 conjugate addition pathway as more favorable energetically than an alternative electrocyclization pat
266 e North Pacific, may only be half as costly, energetically, than high-arctic residency or migration t
268 teractions in the native state are optimized energetically, thereby potentiating slow folding and mis
269 y which liquid water becomes water vapor and energetically this accounts for much of incoming solar r
271 ear by catalytic oxidation of methanol in an energetically unfavorable and atom-inefficient industria
272 of water, making the ring-opening of glucose energetically unfavorable and leaving a high coverage of
273 nd structural properties of siloxanes; it is energetically unfavorable and thus highly unlikely.
274 stasis by chaperoning mature factors through energetically unfavorable events, thereby maintaining th
275 ubstrates and firmly engages them during the energetically unfavorable extraction process remains a m
277 the ligand, but that proton transfer becomes energetically unfavorable in the presence of additional
278 of controllable amount of confined water is energetically unfavorable leading the enhancement of sel
279 that the tryptophan substitutions lower the energetically unfavorable residual hydrophobic mismatch
280 hin the alpha3 helix helps to stabilize this energetically unfavorable state to enable long-chain syn
283 multiexcitonic nature, which stabilizes the energetically unfavorable two-charge separated state by
284 contrast, charge transfer to naphthalene is energetically unfavourable and spectroscopy shows direct
285 uent ordered lipid domains are thought to be energetically unfavourable for membrane fusion, rafts ha
287 show that the guest-free CMOF-5 structure is energetically unstable, with either the achiral conventi
288 cleotide-binding domains (NBDs) to power the energetically uphill efflux of substrates by a dedicated
290 ter from Escherichia coli, EmrE, couples the energetically uphill extrusion of hydrophobic cations ou
291 stry grants access to silyl radicals through energetically uphill reductive cleavage of strong Si-Cl
292 s engaged with natural logs, which contained energetically valuable honey that was only accessible th
293 e oxidation of reduced sulfur species was an energetically viable metabolism for life on early Mars.
294 t ab initio calculations that predict novel, energetically viable reaction mechanisms by which Al-O a
295 moting methylidene formation from carbide as energetically viable relative to the heterolytic cleavag
297 hysisorbed pentene, establishing a series of energetically well-separated groups of reactive surface
298 ation of the observed indole is most favored energetically, while the potential pathway to the minor
299 nd tetrahedra, respectively, were quantified energetically, with the destabilization increasing linea