ライフサイエンスコーパス: atomic level

1 enging due to poor structural control at the atomic level.

2 re, the phase boundary can be manipulated at atomic level.

3 f heterogeneous Li-ion diffusion down to the atomic level.

4 technique to image dynamic processes at the atomic level.

5 ls of initiation-to-elongation transition on atomic level.

6 nce by creating elemental alternation at the atomic level.

7 narity could be controlled chemically at the atomic level.

8 that has not been well characterized at the atomic level.

9 t systems have yet to be investigated at the atomic level.

10 e TiO2(110) surface pre-characterized at the atomic level.

11 hology transition of magnesium alloys at the atomic level.

12 termination of molecular organization at the atomic level.

13 n of pentameric Cys-loop ion channels at the atomic level.

14 pted to reveal the structural features at an atomic level.

15 w nitrosative stress can exert action at the atomic level.

16 r reactions in biological systems at a truly atomic level.

17 y, and decipher associated mechanisms at the atomic level.

18 hiral materials is not yet understood at the atomic level.

19 cules to be analyzed in living cells, at the atomic level.

20 udying non-equilibrium thermodynamics at the atomic level.

21 lignment mechanisms and forces acting on the atomic level.

22 ontrol the catalytically active sites at the atomic level.

23 iodicity and reproducibility of pores at the atomic level.

24 17 binding site has not been described at an atomic level.

25 lear and remain unobserved in action, at the atomic level.

26 complex biomolecules and their functions at atomic level.

27 nsights into architectural intimacies at the atomic level.

28 ls the residue environment as a graph at the atomic level.

29 nding and how menthol activates TRPM8 at the atomic level.

30 f substrate transport remains unclear at the atomic level.

31 ons, describes interaction interfaces at the atomic level.

32 e conformational landscape of proteins at an atomic level.

33 oscale, they are highly inhomogeneous at the atomic level.

34 evolution of Fe-N bonds was examined at the atomic level.

35 iform-flow molecular dynamics simulations at atomic level.

36 tures in PbTiO(3)/SrTiO(3) multilayers at an atomic level.

37 a single nanoparticle to be monitored at the atomic level.

38 brane proteins embedded in lipid bilayers at atomic-level.

39 derstanding of hair cell MT at molecular and atomic levels.

40 h finer effects pertinent at the residue and atomic levels.

41 However, little is known at the atomic level about the hnRNPA2 LCD structure that is inv

42 ty to design megadalton-scale materials with atomic-level accuracy and controllable assembly opens th

43 novo design of homodimers can be achieved to atomic-level accuracy by beta-strand assembly or through

44 the method consistently produced models with atomic-level accuracy largely independently of starting-

45 beta-sheet curvature can be controlled with atomic-level accuracy.

46 structures can be designed from scratch with atomic-level accuracy.

47 imer showed that the design process had near-atomic-level accuracy: The all-atom rmsd between the des

48 planar chemical composition at virtually the atomic level, aimed specifically at studying 2D vertical

49 between covalent bonding taking place at an atomic level and colloidal bonding occurring at the leng

50 ng electrochemical reduction of CO(2) at the atomic level and envisioning the roadmap for C(2) produc

51 antigen have been rationally designed at the atomic level and incorporated in one vaccine.

52 ogical information needs to be decoded at an atomic level and quantum tunnelling has recently been sh

53 high degree of structural homogeneity at the atomic level and that the aggregated protein retains a n

54 ytic performance is further considered at an atomic level and the underlying mechanisms are discussed

55 vide an unbiased description of water at the atomic level and yield information on the underlying mol

56 ermine tropomyosin and myosin contacts at an atomic-level and thus to fully substantiate possible fun

57 l characterisations (from millimetre down to atomic level) and DFT calculations, we demonstrate that

58 he forces acting to stabilize amyloid at the atomic level are highly anisotropic, that an optimized i

59 )Bi), we show that there is a high degree of atomic-level B'(III)/B"(I) site ordering (i.e., no evide

60 ifficult to structurally characterize at the atomic level because the experimental parameters report

61 he twin, has never been characterized at the atomic level, because such boundary is, in principle, cr

62 gen-bonding interactions, while the relevant atomic-level binding modes remain elusive.

63 ral and chemical properties determined on an atomic level by aberration-corrected scanning transmissi

64 that probes local motions of a system at the atomic level by allowing extraction of dynamical paramet

65 tercalation and exfoliation is understood at atomic level by DFT calculations, which reveal the role

66 s between multiple species is possible at an atomic level by looking at different parameters using di

67 he observed activity was rationalized at the atomic level by molecular dynamics simulations.

68 ride fragment were further elucidated at the atomic level by saturation transfer difference NMR spect

69 This can be achieved down to the atomic level by the disorder-to-order transformation of

70 cooperative binding sites, supported at the atomic level by their co-crystal structure bound to DNA,

71 Engineering the surface structure at the atomic level can be used to precisely and effectively ma

72 work, we have investigated the importance of atomic-level characteristics rather than residue level t

73 Here we report atomic-level characterization by magic angle spinning (M

74 ation and methodologies opened new vistas to atomic-level characterization of a plethora of chemical

75 c nuclear polarization (MAS DNP) has allowed atomic-level characterization of materials for which con

76 lution challenges are overcome, enabling the atomic-level characterization of membrane proteins in li

77 Our findings provide an atomic-level characterization of the genome release mech

78 A physical model is presented to explain the atomic-level chemistry and structure of these thermally

79 ty-targeted quantitative design approach for atomic-level complexity in complex concentrated and high

80 tance of understanding their behavior at the atomic level, computational modeling, a premier high-res

81 While the atomic-level consequences of cleavage for HIV-1 Env are

82 ve not, as yet, succeeded at determining key atomic-level contacts between these proteins or fully su

83 ized by various experimental techniques, the atomic-level contributions of various secondary structur

84 dispersed bimetallic cluster catalysts with atomic-level control of dopants has been a long-standing

85 colloidal nanoplatelets (NPLs), owing to the atomic-level control of their confined direction (i.e.,

86 Atomic-level control of thickness thus enables generatio

87 e boosted catalytic performance roots in the atomic-level coordinatively unsaturated sites (CUS).

88 Modifications of local structure at atomic level could precisely and effectively tune the ca

89 e" mechanical response and uniform molecular/atomic level deformation of the organic biopolymer in th

90 ements are analyzed to reveal details of the atomic-level deformation and flow processes of amorphous

91 e-scale cryo-EM-based structure modeling and atomic-level density map-guided structure refinement.

92 he water structure is employed to provide an atomic level description of ligand and protein desolvati

93 molecular dynamics simulations, providing an atomic-level description of alternating access transport

94 Here we present a quantitative, atomic-level description of the functional thermodynamic

95 on cryotomography map, resulting in a pseudo-atomic-level description of the in vivo S-layer, which a

96 Here, we report an atomic-level description of the reaction of the UbiD-rel

97 s), but it has proven difficult to obtain an atomic-level description of the structural mechanisms by

98 We provide an atomic-level description of the structure and dynamics o

99 Collectively, our results establish an atomic-level description of the underlying mechanism reg

100 uron, Gharpure et al. (2019) nearly complete atomic-level descriptions for binding, permeation, and s

101 n favourable cases is it possible to provide atomic-level descriptions of sparsely populated and tran

102 essential in the enzymatic process, complete atomic-level descriptions of these steps are difficult t

103 on reaction, and highlight the importance of atomic-level descriptions.

104 gnetic resonance spectroscopy to describe in atomic-level detail how Abl kinase interconverts between

105 The present structure reveals atomic-level detail in capsid architecture and provides

106 idylserine membrane recognition by Tim1 with atomic-level detail.

107 echniques have been correlated to illuminate atomic-level details of bond breaking and formation duri

108 precedented ability of computations to probe atomic-level details of catalytic systems holds immense

109 tions are used to capture the energetics and atomic-level details of Mg(2+)-RNA interactions that occ

110 To obtain atomic-level details of the re activation process, we ca

111 However, atomic-level details on the conformational transitions a

112 osystem II allows us to identify the precise atomic-level differences between organisms in the vicini

113 ains, however, mostly uncharacterized at the atomic level due to its intrinsic flexibility.

114 pret experimental results and understand the atomic-level dynamics of chemical reactions; (2) illustr

115 ques, opening opportunities for studying the atomic-level dynamics.

116 outes, (2) functionalization of g-C3N4 at an atomic level (elemental doping) and molecular level (cop

117 affinity of these interactions, have limited atomic-level elucidation of the amyloid-promoting mechan

118 sing the FastRelax application of Rosetta or atomic-level energy minimization based ModRefiner method

119 on of hydrogen bonding network combined with atomic-level energy minimization on the optimized model

120 s no experimental information on the initial atomic level events for CO(2) electroreduction on the me

121 rall, the hZAP RBD RNA structure provides an atomic-level explanation for how ZAP selectively targets

122 Using atomic-level features an ensemble-classifier, ANuPP has

123 of unequivocal structural information at the atomic level for complex systems is uniquely important f

124 methods, no direct observation of DPD at the atomic level has been reported.

125 to manipulate and visualize single atoms at atomic level has given rise to modern bottom-up nanotech

126 g the nature of the molecular species at the atomic level has led to the identification of a unique C

127 his kind of GB motion comes into play at the atomic level has not been fully revealed.

128 uctural modification of nanomaterials at the atomic level has the potential to generate tailor-made c

129 Using atomic level imaging, spectroscopic analysis and density

130 Here we develop an optimized atomic-level imaging condition to measure TiO6 octahedra

131 s, uncovering a metabolic link at the carbon atomic level in ammonia metabolism of A. aegypti.

132 d in the interior cavity of the AACs, on the atomic level in the solid state and in solution, accompa

133 This study provides atomic level information for an important drug target to

134 ear magnetic resonance (NMR) spectra provide atomic level information for each amino acid within a pr

135 n rules that enable effective utilization of atomic level information to reduce the immense degrees o

136 sp3 plus increasing amounts of Cu(I) provide atomic-level information about how a storage protein loa

137 Atomic-level information about the structure and dynamic

138 These results provide atomic-level information on the molecular mechanism of C

139 Over the last 15 years, the availability of atomic-level information on the structure of the CLCs, c

140 To gain additional atomic-level information, the experiments are complement

141 lear magnetic resonance spectroscopy to gain atomic level insight into the structural differences bet

142 As a result, gaining atomic-level insight into the catalytic mechanism via el

143 Molecular dynamics provide atomic-level insight into the loop configurations.

144 nitio molecular-dynamics simulations provide atomic-level insight into the nature of these interactio

145 ar Dynamics (MD) simulations seek to provide atomic-level insights into conformationally dynamic biol

146 These atomic-level insights into peptoid nanosheet crystal str

147 e in such a large alloy nanocluster provides atomic-level insights into the Au-Ag bonds in bimetallic

148 pic data and provide previously unattainable atomic-level insights into the fundamental mechanism of

149 These data provide atomic-level insights into the molecular mechanism of th

150 rent oxide monocrystal model systems enables atomic-level insights into the structural, electronic, a

151 ncies present in the samples, thus providing atomic-level insights into the structures of colloidal T

152 of prototypical RRNPP members have provided atomic-level insights into their mechanism and regulatio

153 Atomic-level insights presented here will aid structure-

154 derstood, largely owing to a lack of in-situ atomic-level insights.

155 sing solid-state MAS NMR, we demonstrate the atomic-level interaction between the molecular modulator

156 e of huBuChE in complex with 16 revealed the atomic-level interactions and offers opportunities for f

157 ensive structural analyses have revealed key atomic-level interactions between the SARS-CoV spike pro

158 The structure and the atomic-level interactions were determined by saturation

159 simulations reveal that the introduction of atomic-level interfaces can lower the oxidation overpote

160 The present NMR-driven study provides an atomic-level investigation of the structural and dynamic

161 duces changes in the structure of NAs at the atomic level is a challenge.

162 tive site embedded in complex systems at the atomic level is critical to developing efficient photoca

163 red and long-range ordered structures at the atomic level is extremely rare and so far has only been

164 tural evidence for how DnaB functions at the atomic level is lacking.

165 al bonds, structural characterization at the atomic level is most useful.

166 nce under an external magnetic field, at the atomic level is of great interest both fundamentally and

167 ltiple uniform HTS junctions, control at the atomic level is required.

168 Understanding the causes at an atomic level is vital for the synthesis of more robust C

169 in order to approach an understanding at the atomic level, it is necessary in a first step to drastic

170 e goals of SARS-CoV research was to build an atomic-level iterative framework of virus-receptor inter

171 search process, with functions specified by atomic-level ligand-protein binding interactions.

172 Since the advent of protein crystallography, atomic-level macromolecular structures have provided a b

173 ursuit, yet little has been achieved for the atomic-level manipulation of metallic nanomaterials.

174 Here we illustrate an atomic level mechanism for this activity with a crystal

175 ion binding in ClC-ec1 and reveal a putative atomic-level mechanism for the decoupling of H+ transpor

176 ular dynamics simulations to investigate the atomic-level mechanism of conformational coupling in the

177 Despite intense research efforts, the atomic-level mechanism transmitting chemical energy from

178 The atomic-level mechanisms by which G protein-coupled recep

179 s in natural and manufactured materials, the atomic-level mechanisms governing their deformation and

180 een implicated in human disease, the precise atomic-level mechanisms remain opaque, greatly hampering

181 The atomic-level mechanisms that coordinate ligand release f

182 at understanding reaction barriers based on atomic-level mechanisms.

183 Despite extensive structural studies, atomic-level mechanistic details of such structural tran

184 s has been characterised to a level where an atomic-level membrane model is available, but the roles

185 to a critical lack of methods to probe their atomic-level microstructure.

186 s of PECAM-1 allow for the development of an atomic-level model of the interactions that PECAM-1 form

187 mentary steps in the activation process, and atomic-level modeling of the effects of missense mutatio

188 uss the three best-studied MCPs highlighting atomic-level models for shell assembly, targeting sequen

189 and highlights the need for next-generation atomic-level models of the ion atmosphere.

190 Atomic-level molecular dynamic simulations are capable o

191 Here, we use extensive atomic-level molecular dynamics simulations to determine

192 Here, we elucidate the atomic-level nature of Cs and Rb incorporation into the

193 the challenges one faces to characterize at atomic level of detail the conformational space of disor

194 dissociation remains to be understood at the atomic level of detail.

195 al origin of the TBs-related cracking at the atomic level of gamma"-strengthened Ni-based superalloys

196 the severity of genetic perturbations at the atomic level of protein structure.

197 or studying van der Waals interactions at an atomic level offers unprecedented opportunities in the f

198 Protein catalysis requires the atomic-level orchestration of side chains, substrates an

199 ectron microscopy structures that reveal the atomic-level organization of the K(ATP) channel complex.

200 l group characteristics towards diversity of atomic level origins as well as mechanisms of protein ag

201 d has been actively investigated approaching atomic level patterning.

202 This work provides atomic-level perspective on the inhibition of SETD8 by s

203 s, which is combined with a newly developed, atomic-level physical energy function to guide the repli

204 wide, computational assessment of changes to atomic-level physicochemical properties and of oxidative

205 Hence, developing methods to build an atomic level picture of these interactions helps improve

206 Determining a complete atomic-level picture of how minerals grow from aqueous s

207 lity to design and construct structures with atomic level precision is one of the key goals of nanote

208 ination of three-dimensional structures with atomic-level precision.

209 lloys, based on quantum-mechanically derived atomic-level pressure approximation.

210 The atomic-level process of CH4-SnO2 interaction and tempera

211 chanisms that guide these transitions at the atomic level promises to impact our understanding of fun

212 Accurate prediction of atomic-level protein structure is important for annotati

213 Engineering catalytic sites at the atomic level provides an opportunity to understand the c

214 alculations was used to unravel the complete atomic-level random Bi(3+)/In(3+) cationic mixing in Cs(

215 c structure arising from fluctuations at the atomic level rather than static size distribution.

216 es and molecular diodes that are amenable to atomic-level re-engineering.

217 i30-membrane interplay works structurally at atomic level resolution in Arabidopsis (Arabidopsis thal

218 We used these peptides to investigate, at atomic-level resolution, how these amino acid substituti

219 inter- and intramolecular interactions at an atomic-level resolution.

220 to fold into structures with high fold- and atomic-level similarity to their corresponding native st

221 lation influences arrestin behavior by using atomic-level simulations and site-directed spectroscopy

222 Here, we report the results of atomic-level simulations in which we observed five prote

223 ing conformational changes that occur during atomic-level simulations of biomolecules such as protein

224 Using atomic-level simulations of diverse GPCRs, we show that

225 Atomic-level simulations suggest that the agonist-indepe

226 Here we use atomic-level simulations to elucidate the nucleotide-rel

227 solution to this challenge as they allow for atomic-level spatial control of the molecular subunits t

228 Realizing atomic-level spatial control over qubits, the fundamenta

229 The inherent atomic level structural control of synthetic chemistry e

230 NMR can provide residue specific atomic level structural information, but its implementat

231 olloidal nanoclusters as a function of their atomic-level structural characteristics.

232 e, we review what has been learned from this atomic-level structural characterization of affinity mat

233 To address the dearth of atomic-level structural characterization of heterochiral

234 to derive direct correspondence between the atomic-level structural correlations and reported proper

235 To identify key functional residues, we used atomic-level structural data to guide mutagenesis of VP2

236 ly cryo-EM does not routinely give access to atomic-level structural data, and, generally, NMR struct

237 g by molecular dynamics simulations provides atomic-level structural detail of medin pores with the C

238 Our results elucidate non-intuitive atomic-level structural details of DX-based DNA nanopart

239 ent temporal and spatial resolutions to gain atomic-level structural information and energetics on li

240 H-sensing intersubunit interface in GPC, but atomic-level structural information is unavailable.

241 Atomic-level structural investigations revealed three at

242 Murray et al. report an atomic-level structural model for FUS LCD fibrils that a

243 pathological aggregation, and we present an atomic-level structural model for the TDP-43 dimer based

244 Building on an atomic-level structural model of a low-light-adapted chr

245 need for robust methods to create and refine atomic-level structural models using low-resolution EM d

246 We conclude that our atomic-level structural observations represent a paradig

247 e materials is crucial to unravel the unique atomic-level structural properties which are difficult t

248 model of the D3R derived from the available atomic level structure, and comparisons to the receptor

249 ization is crucial for understanding how the atomic-level structure affects the chemical and photophy

250 rates, we conclude that there is no fractal atomic-level structure associated with the packing of al

251 Together with other details, our atomic-level structure may provide a foundation for stru

252 re fitting, flexible fragment adjustment and atomic-level structure refinement simulations.

253 characterizing and describing the disordered atomic-level structure.

254 with available electron microscopy maps and atomic level structures from NMR spectroscopy and x-ray

255 our understanding of chemistry derives from atomic-level structures obtained with single-crystal X-r

256 receptors using different techniques, define atomic-level structures of virus-glycan complexes, and s

257 Our atomic level study allows analyzing the vesicle surface

258 However, atomic level study of PbI(2) monolayer has been limited

259 can even increase during annealing motivates atomic-level study of dislocation structures of both <00

260 ake this approach broadly applicable for the atomic-level study of large RNAs.

261 Our study elucidates at atomic level that the hydrophobicity and substitution ge

262 te NMR, and solid-state NMR to follow at the atomic level the assembly of the CRES amyloidogenic prec

263 otein partner BOLA2, we characterized at the atomic level the interaction of apo BOLA2 with the apo a

264 n electron microscopy, for the first time at atomic level, the dynamic evolution of the Cu surface is

265 Hence, at the atomic level, the Malagasy clays are genuine mineralogic

266 y sheltering the quantum state in the ground atomic levels, the storage time is increased by almost t

267 Atomic-level three-dimensional (3D) structure data for b

268 experimental data probing WDM states at the atomic level to test current models and those performed

269 This constitutes an atomic-level tool to override locally the preferred glob

270 ransmission electron microscopy to probe the atomic-level transformations at Cu2O/Cu interfaces as th

271 The atomic-level transformations of all reactant moieties, t

272 (1)H photo-CIDNP for characterizing, at the atomic level, transient species involved in electron-tra

273 This finding provides an atomic level understanding for developing highly efficie

274 and first principles calculations to provide atomic level understanding of the structure and properti

275 ncy and discover new active combinations, an atomic-level understanding and control of the catalyst s

276 assembling properties and pave the way to an atomic-level understanding of amyloid inhibition.

277 n systems at ab initio level, which provides atomic-level understanding of chemical reaction processe

278 In this study, we contribute an atomic-level understanding of how methadone exerts its u

279 sign of multicomponent nanocrystals requires atomic-level understanding of reaction kinetics.

280 Our findings thus provide an atomic-level understanding of technologically important

281 ic active sites are the prerequisites for an atomic-level understanding of the catalytic mechanism an

282 ovides an important platform for probing the atomic-level understanding of the fundamental mechanisms

283 and provide a starting point for a detailed atomic-level understanding of the mechanisms of SOD1 oli

284 Thus, quantitative atomic-level understanding of the relationships between

285 This has provided an atomic-level understanding of the water-TiO2 interaction

286 nanomaterials fundamentally depends upon an atomic-level understanding of their structure and how it

287 the active site of CAIX were explored on the atomic level using protein crystallography.

288 The interface is characterized on the atomic level utilizing scanning transmission electron mi

289 it P450 2B4 (CYP2B4) and rabbit cytb5 at the atomic level, utilizing NMR techniques.

290 The structure represents the first atomic-level view of an oligomeric array formed by a mem

291 An atomic-level view of the azole synthetase is a starting

292 w class of nanomaterials that can provide an atomic-level view of the crystal structure of copper nan

293 erstand the protein-template mechanism at an atomic level, we employed a combination of time-lapse X-

294 ntal understanding of their properties on an atomic level, we investigate single crystals of CH3NH3Pb

295 To elucidate the underlying mechanism at the atomic level, we modeled the Tsn/MHC I complex using all

296 formational determinants of allostery at the atomic level were examined in molecular dynamics simulat

297 requires engineering electrocatalysts at the atomic level, which is a grand challenge.

298 tection of the energy difference between two atomic levels, which is measured in terms of the quantum

299 relationship of RNA both in real time and at atomic level will have a profound impact in advancing ou

300 riggered activation approach detected on the atomic level with high-resolution protein NMR spectrosco