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1 n of exposure as binary or continuous in the structural model.
2 ng further support for the well-corroborated structural model.
3 of coimmunoprecipitation assays and protein structural models.
4 ure contact maps can assist the selection of structural models.
5 ght not be enough to propose high-resolution structural models.
6 rvival using time-dependent Cox and marginal structural models.
7 igating similarities and differences between structural models.
8 model clustering to rank and select protein structural models.
9 information to obtain these mixed-resolution structural models.
10 stic sampling of any set of models, not just structural models.
11 evere hypoxemia) at day 30, we used marginal structural models.
12 l lipid binding studies were consistent with structural modeling.
13 n mutant GABAA receptors were explored using structural modeling.
15 cells, and >2,000 RosettaAntibody-predicted structural models across three healthy donors led to a n
19 toms on time to death using a joint marginal structural model and data from a cohort of HIV-infected
20 e support the functional significance of the structural model and indicate that the same interaction
22 Sensitivity analyses, including marginal structural modeling and controlling for viral load and f
23 describe opportunities and challenges in RNA structural modeling and design, as recently discussed du
24 e to the NaV1.7 S241T mutation, predicted by structural modeling and functional analysis to be respon
25 ly unannotated PC dominated the dataset, but structural modeling and genomic context identified this
27 tly solved crystal structure of Hv1, we used structural modeling and molecular dynamics simulations t
32 sk of cardiovascular event by using marginal structural models and Cox models extended to accommodate
33 ombinant allergens were correctly folded and structural models and patient reactivity profiles sugges
35 s-linking and mass spectrometry, comparative structural modeling, and genetic and biochemical analyse
36 entry using molecular-dynamics simulations, structural modeling, and in vitro and in vivo functional
37 ality scores (i.e. GDT-TS scores) of protein structural models, and uses them to estimate its probabi
38 ool for assessing the adequacy of a proposed structural model as well as for future model development
40 tructural optimizations do not give accurate structural models, as assessed by the experimental chemi
41 surements on the 3FD-IL nanosheets support a structural model based on a honeycomb lattice, in which
42 MG improves the GDT-TS score and TM-score of structural models by 2.96-6.37% and 2.42-5.19% on the th
43 unity and indicate that dynamics-inspired NM structural models can simultaneously agree with both Bra
46 on for arbitrary protein families leading to structural models complementary to often-difficult exper
48 d straightness of newly polymerized MTs, and structural modeling data suggest a conformational change
50 for such comparative studies have focused on structural models determined at atomic resolution, and m
51 we argue that primary sequence analysis and structural modelling do not readily explain why NasA, Na
56 Rietveld refinement yielded a monoclinic structural model for a well-crystalline tridymite, consi
60 Not only is the title complex thus the best structural model for CuZ* to date, but it also serves as
69 Candida colonization), and using a marginal structural model for longitudinal data, treatment was no
70 NSS homologue, LeuT, represents a principal structural model for Na(+)-coupled transport catalyzed b
72 er, currently, there is a lack of a detailed structural model for the active state of the twister rib
73 f the complete transport process, offering a structural model for the alternating-access mechanism an
75 raction within eIF2alpha; and (ii) the first structural model for the complex of eIF2B with its subst
76 resented in this work allows us to propose a structural model for the molecular interaction of the Sp
78 dynamics simulation procedures, we provide a structural model for the subdomain-mediated tetramer/tet
80 aggregation, and we present an atomic-level structural model for the TDP-43 dimer based on NMR data.
83 olecular modeling protocols, have provided a structural model for the TTR-Abeta interaction, as well
89 riments, and existing NMR data, we developed structural models for all three states of the protein.
92 function from multiple organisms and curated structural models for each variant from crystal structur
93 he server automatically provides a series of structural models for the complex, sorted by the pyDockS
94 tures providing chemical starting points and structural models for the development of potent and sele
95 o generate and functionally test data-driven structural models for three diverse HCV RNA genomes.
96 ll needs to be filled with a high-resolution structural modeling framework, which includes a minimall
98 n channelrhodopsin crystal structure, and by structural model-guided redesign of channelrhodopsins fo
100 binding interface as indicated by HDX MS and structural modeling; however, HC Met257 oxidation was fu
105 talysis and substrate binding, and support a structural model in which rearrangement of a flexible lo
106 state-of-the-art in these various aspects of structural modeling in cellular biology, and the prospec
113 RP3 PYD abrogate inflammasome activation and structural modeling indicates that phosphorylation of th
117 e mechanism of the NMDA receptor activation, structural modeling is essential to provide presently mi
118 acy and coverage of three-dimensional genome structural models, it is important to integrate all avai
120 croscopy, 3D reconstruction, and integrative structural modeling methods to determine the molecular a
122 stimation of causal parameters from marginal structural models (MSMs) requires a fundamental assumpti
123 rs measured at baseline, and fitted marginal structural models (MSMs) that more fully adjusted for co
129 llographic and AFM data were used to build a structural model of a membrane landscape comprising 96 P
132 r dynamics simulations, we have identified a structural model of an ApoE4 misfolded intermediate stat
133 We present what we believe to be the first structural model of an ApoE4 misfolded intermediate stat
134 ed and validated sites of modifications on a structural model of C9, as present in the MAC, hints at
139 ar coupling data, functional analysis, and a structural model of GCAP1 mutant (GCAP1(V77E)) in the Ca
140 OPG) is an important electrode material as a structural model of graphitic nanocarbons such as graphe
142 ng these sequence variations, we developed a structural model of Hsp21 based on homology modeling, cr
145 immunity to B. cinerea Finally, we present a structural model of MOS7 and show that the mos7-1 mutati
147 ation system informs revision of the current structural model of rhamnogalacturonan-II and highlights
151 tural, and biophysical methods, we present a structural model of the 400-kDa Cas14-Cas2-32 complex fr
152 h previous N. crassa CYT-18 structures and a structural model of the Aspergillus fumigatus mtTyrRS sh
153 This extensive data set informs the first structural model of the CAF and provides insights into h
156 f UP1 binding HIViSL3(ESS3) by determining a structural model of the complex scored by small-angle X-
160 Previously we have determined a complete structural model of the in vitro reconstituted COPI coat
164 these data, we developed a three-dimensional structural model of the Nup82 complex that depicts how t
165 correspond well with the predictions of our structural model of the oligomers constructed from molec
167 with the histone chaperone Asf1 and deduce a structural model of the Vps75-Asf1-H3-H4 (VAH) co-chaper
168 sed representations allowed us to generate a structural model of this major epitope and its antibody
173 formed comparative evolutionary analysis and structural modeling of ABHD5 and ABHD4, a functionally d
176 general strategy that may be employed in the structural modeling of equilibrium intermediate states o
178 ew illustrates the developing shift from the structural modeling of individual molecules to that of c
179 xperimental data into simulations toward the structural modeling of metastable, multidomain aggregati
189 utics would benefit from improved, in-silico structural modeling of the kinase's solution ensemble.
191 r identical laboratory protocols and permits structural modelling of experimental measurements, allow
195 Here, we present three three-dimensional structural models of human MFSD2A derived by homology mo
201 ilies proves sufficient to assemble accurate structural models of the diverse protein-oligomers.
203 hen applied it to generate an ensemble of 3D structural models of the genome of human B-cells from a
206 ant biological evidence in support of recent structural models of the RSV immature virions and furthe
207 rce microscopy to deliver, in atomic detail, structural models of three key PANS: the hexasome (H2A.H
208 In observational analyses, dynamic marginal structural models on pooled randomized groups were used
212 First-principles calculations based on the structural model predicted a strong preference for a sin
217 ly, we discuss the features of a full-length structural model produced by small angle x-ray scatterin
219 classification performance, and analysis of structural models provides physical insight into the str
228 Cellular and biochemical analyses as well as structural modelling revealed that two mutations disrupt
235 e cerebral cortex: architectonic similarity (structural model), spatial proximity (distance model) an
248 gous interaction site on tomosyn-1 and Lgl-1 structural models suggests a possible conserved Rab GTPa
249 ron scattering (SANS) were consistent with a structural model that involves formation of borate dimer
250 ommensurate superstructure and suggest a new structural model that is consistent with recent theoreti
251 by small- angle x-ray scattering suggests a structural model that places the receptor-binding site o
252 complementary approaches resulted in a novel structural model that rationalizes previous experimental
253 ill, we demonstrate specific deficiencies of structural modeling that must be addressed to enable tru
254 Ms often rely on untestable scenarios, or on structural models that are comparatively untested on rel
255 ollowed is based, for the first time, on two structural models that can be fitted simultaneously, and
256 niquely test the more than one dozen crystal structural models that have been proposed for vaterite.
257 otor ring assembly on DNA, supporting recent structural models that locate the P-loop at the interfac
258 anning up to 56 nucleotides in length yields structural models that recapitulate experimentally deter
260 ur findings provide biochemical insights and structural models that will facilitate studying poxvirus
261 e with inverse probability-weighted marginal structural models, the structural transformation method,
262 or quality of the fit found for the original structural model-the NMR data can be largely accommodate
263 By structurally threading low-resolution structural models through the BioLiP library, the COFACT
265 oscopy, cross-linking mass spectrometry, and structural modeling to build a complete model of human R
266 peting risk survival regression and marginal structural modeling to estimate ICU mortality caused by
267 we apply cross-linking/mass spectrometry and structural modelling to determine the molecular architec
270 multivariable linear regression and marginal structural models to estimate associations under 2 causa
271 s as causal mediators, we also used marginal structural models to estimate the controlled direct effe
272 es of the resulting fragment ions by fitting structural models to experimentally determined collision
273 significance is established, comprises both structural model uncertainty and natural climate variabi
274 ng of the identified mutations onto the SHMT structural model uncovered key residues for structural s
276 of their treatment, by estimating a marginal structural model using data from the Australia and New Z
277 at the Na1 site were previously predicted by structural modeling using the x-ray structure of dicarbo
279 seamlessly integrates sequence analysis and structural modelling (using the Rosetta protein modellin
280 hrough a validated connexin26 (Cx26) channel structural model, using molecular dynamics and associate
285 g genetic analysis, photo-cross-linking, and structural modeling, we show that DksA binds and acts up
286 Based on a combination of mutagenesis and structural modeling, we suggest that all benzothiazole/o
287 ording, immunoblotting, confocal imaging and structural modelling, we characterized the effects of th
288 Clear structure-activity relationships and a structural model were developed in the studies which pro
292 ceptors at the PSD and are consistent with a structural model where MAGUKs, corresponding to membrane
293 crimination capacity, the technique delivers structural models which can subsequently serve as an inp
294 t is the resilience pathway suggested by the structural model, which is highly amenable to interventi
295 lose was also explained on the basis of a 3D structural model, which was compared to the 3D structure
296 otein structures, we considered high-quality structural models, which increase genomic coverage from
297 omain-ligand interaction was explained by 3D structural models, which showed a hormone-regulated mech
299 d additionally facilitates comparison across structural models with different levels of details with
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