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1 sly split the colonies, creating a patterned replica.
2 ilting, and from deep-etched rotary-shadowed replicas.
3 luation of gingival recession marks on stone replicas.
4 ular architectures to form conductive carbon replicas.
5  scratched into the anterior segments of the replicas.
6 by the reactive conversion into Si or TiO(2) replicas.
7 cy of ordinary replica exchange, using fewer replicas.
8 p, this approach mitigates the need for many replicas.
9 s performed for 226 ns per replica, using 52 replicas.
10 ies into microporous nanocrystalline silicon replicas.
11  self-assembled organic phase into inorganic replicas.
12 ntial growth of both octahedron and catalyst replicas.
13 gate sampling of 15 mus when summed over all replicas, allowing us to explicitly calculate the free-e
14 strate it by applying it to both a synthetic replica and an experimental preparation of a two-dimensi
15 ons of mesoporous silicates, their nonsilica replicas and composites are discussed including the comb
16        The protocol has been set up on paint replicas and successfully tested on two historical sampl
17 NA/RNA oligonucleotides transfer to the PDMS replica, and the DNA oligonucleotides remaining on the m
18 al and code sequences are transferred to the replica, and the zip code remains on the surface of the
19 e four key steps in making a freeze-fracture replica are (i) rapid freezing, (ii) fracturing, (iii) r
20 st function, with a constraint centering the replicas around a driving assignment.
21 ster array are ready to template another RNA replica array.
22 ely 100 microm can be faithfully replicated, replica arrays consisting of several different oligonucl
23 lting ensemble of structures with one or two replicas, as they are under the strong influence of soli
24 duct of the canonical distributions of these replicas at the different temperatures.
25                 In this work we use all-atom replica-averaged metadynamics (RAM) simulations with NMR
26 plex using NMR residual dipolar couplings in replica-averaged metadynamics simulations, we observe tw
27 ical shifts used as structural restraints in replica-averaged metadynamics simulations.
28 sing methyl chemical shifts as restraints in replica-averaged molecular dynamics (MD) simulations, wh
29  surface of RNase A using chemical shifts as replica-averaged restraints in molecular dynamics simula
30 hairpin by incorporating NMR measurements as replica-averaged restraints in molecular dynamics simula
31 in (Ca(2+)-CaM) using NMR chemical shifts as replica-averaged structural restraints in molecular dyna
32 milar to the results in FeSe/STO(001), clear replica bands are observed.
33                           The observation of replica bands in single-unit-cell FeSe on SrTiO3 (STO)(0
34 , our angle-resolved photoemission data show replica bands separated by 100 meV from the main bands.
35  STO(110) bare surfaces, and observe similar replica bands separated by approximately the same energy
36 orrelated with the signals registered (seven replicas) by means of the electronic nose and the electr
37  molecule, full-functional peroxidase enzyme replicas called "TAML activators".
38                  In addition, metallic glass replicas can also be used as moulds for polymers or othe
39                                     Up to 10 replicas can be prepared from a single master with no de
40 k between telomeric loops shared by template-replica chromatids is conceptualized in terms of homotop
41  (ii) fracturing, (iii) replication and (iv) replica cleaning.
42 placement are consistent with a recent exact replica computation for d = infinity, whereas some obser
43                               Using platinum replica electron microscopy (PREM), we have characterize
44                               Using platinum replica electron microscopy in combination with electron
45                               Using platinum replica electron microscopy in combination with immunogo
46                               Using platinum replica electron microscopy, we characterized the cytosk
47                         Here, using platinum-replica electron microscopy, we find that the early hour
48  AIS membrane "undercoat' imaged by platinum replica electron microscopy.
49                               We introduce a replica exchange (parallel tempering) method in which at
50 constant-pH molecular dynamics with pH-based replica exchange (pH-REX) to gain insight into the struc
51                                              Replica exchange (RE) is a generalized ensemble simulati
52 ed Born (GB) implicit solvent, combined with replica exchange (REX), might offer an optimal balance b
53 ted molecular dynamics (MD) with Hamiltonian Replica Exchange and calculated binding free energy chan
54 f HP35 folding emerges when the results from replica exchange and conventional molecular dynamics sim
55 cular dynamics trajectories from Hamiltonian replica exchange and targeted molecular dynamics simulat
56  Htt17Q17, and Htt17Q17P11 using Hamiltonian replica exchange combined with well-tempered metadynamic
57             In this work, we postprocess the replica exchange data using our roadmap-based MaxFlux re
58 ries of macrocycle structures generated from replica exchange dynamics to fully sample the conformati
59 ipping was further examined with Hamiltonian replica exchange free energy calculations revealing a st
60                                   We perform replica exchange MD (REMD) simulations and find that cla
61  ns of conventional MD, as well as 160 ns of replica exchange MD (REMD), with the GLYCAM06 force fiel
62                        The biasing potential-replica exchange MD simulations indicated significant di
63 range of urea concentrations, using all-atom Replica exchange MD simulations.
64 namics (MD) simulations, our method combines replica exchange MD with transition path theory (TPT) to
65                                      We used replica exchange molecular dynamics (MD) simulations to
66 puted by Poisson-Boltzmann (PB) equation and replica exchange molecular dynamics (MD).
67                                              Replica exchange molecular dynamics (REMD) calculations
68                                              Replica exchange molecular dynamics (REMD) is a popular
69 ree peptoid sequences using a combination of Replica Exchange Molecular Dynamics (REMD) simulation an
70 ut approximately 3 microsecond long all atom replica exchange molecular dynamics (REMD) simulations f
71                        In this work, de novo replica exchange molecular dynamics (REMD) simulations o
72 energy landscape of the T-loop, we performed replica exchange molecular dynamics (REMD) simulations o
73 tion of nuclear magnetic resonance (NMR) and replica exchange molecular dynamics (REMD) simulations t
74                                 Here, we use replica exchange molecular dynamics (REMD) simulations t
75 lity mass spectrometry (IMS-MS) and all-atom replica exchange molecular dynamics (REMD) simulations.
76  and tetra-acetylated H4 histone tails using Replica Exchange Molecular Dynamics (REMD) simulations.
77 ss spectrometry (IMS-MS) in conjunction with replica exchange molecular dynamics (REMD) to examine th
78 units are examined in explicit solvent using replica exchange molecular dynamics (REMD) which provide
79 btained from extensive folding and unfolding replica exchange molecular dynamics (REX-MD) simulations
80                                              Replica exchange molecular dynamics and an all-atom impl
81           In this article, we use exhaustive replica exchange molecular dynamics and an implicit solv
82 -resolution model with umbrella sampling and replica exchange molecular dynamics and performed altoge
83                                            A replica exchange molecular dynamics computational approa
84                     To this end, a series of replica exchange molecular dynamics computer simulations
85 ece subdomain HP35, we conducted two sets of replica exchange molecular dynamics for 200 ns each and
86 nal space of the Cro dimer in solution using replica exchange molecular dynamics in explicit solvent.
87                                              Replica exchange molecular dynamics is used to explore t
88                       This umbrella-sampling replica exchange molecular dynamics method performs a re
89                 Size-modified PB agrees with replica exchange molecular dynamics much better than non
90  tetraloop hairpin using a serial version of replica exchange molecular dynamics on a distributed com
91 nal landscape is conducted using temperature replica exchange molecular dynamics over three isochores
92                      We show that the use of replica exchange molecular dynamics predicts the structu
93 xchange molecular dynamics method performs a replica exchange molecular dynamics simulation along pep
94                                        Using replica exchange molecular dynamics simulations and an a
95 lected CTFs [Abeta(x-42); x=29-31, 39] using replica exchange molecular dynamics simulations and ion
96                                        Using replica exchange molecular dynamics simulations and the
97                                          Our replica exchange molecular dynamics simulations further
98 nal switch via extensive atomically detailed replica exchange molecular dynamics simulations in expli
99                      Our NMR experiments and replica exchange molecular dynamics simulations indicate
100                    We apply these methods to replica exchange molecular dynamics simulations of a set
101                                    Extensive replica exchange molecular dynamics simulations of BBL i
102 del parameterization is accomplished through replica exchange molecular dynamics simulations of short
103 and aggregation of the Abeta peptide through replica exchange molecular dynamics simulations of the 1
104 his question using all-atom explicit solvent replica exchange molecular dynamics simulations of three
105                           We first performed replica exchange molecular dynamics simulations of wild-
106                     We carried out extensive replica exchange molecular dynamics simulations on 1BBL
107         In this work, we perform constant pH replica exchange molecular dynamics simulations on both
108                                 We performed replica exchange molecular dynamics simulations on the C
109 t membrane model is used in conjunction with replica exchange molecular dynamics simulations to reach
110 ed Born implicit solvent/membrane model with replica exchange molecular dynamics simulations to sampl
111                                    We employ replica exchange molecular dynamics simulations to study
112                                          The replica exchange molecular dynamics simulations used an
113 sembly of the KFFE peptide was studied using replica exchange molecular dynamics simulations with a f
114 le of histone tails in the nucleosome, using replica exchange molecular dynamics simulations with an
115 rpose, we have performed extensive atomistic Replica Exchange Molecular Dynamics simulations, elucida
116 lly reproduced to angstrom-level accuracy in replica exchange molecular dynamics simulations, includi
117 lyzed statistically and compared to standard replica exchange molecular dynamics simulations.
118 ss spectrometry experiments and solvent-free replica exchange molecular dynamics simulations.
119                                            A replica exchange molecular dynamics study of the r(CGUUG
120 ulations on NCBD to date: we use large-scale replica exchange molecular dynamics to explore the unbou
121                                     By using replica exchange molecular dynamics we carried out exten
122          All-atom explicit solvent model and replica exchange molecular dynamics were used to investi
123                                        Using replica exchange molecular dynamics with extensive sampl
124 d atom implicit solvent model and exhaustive replica exchange molecular dynamics.
125 ment of assembled structures using reservoir replica exchange molecular dynamics.
126  area implicit solvent model and sampling by replica exchange molecular dynamics.
127 s obtained from reversible folding/unfolding replica exchange molecular-dynamics simulations of Trp-c
128 -angle x-ray scattering, as well as all-atom replica exchange molecular-dynamics simulations, we show
129 s within the mucus layers using an efficient replica exchange Monte Carlo sampling procedure.
130 en coupled with a simple energy function and replica exchange Monte Carlo simulation, our CNF method
131                                              Replica exchange Monte Carlo simulations using a coarse-
132 lymer lattice model and stochastic sampling (replica exchange Monte Carlo) for canonical ensemble sim
133            This method, known as Hamiltonian Replica Exchange Monte Carlo, outperforms the original M
134  ensemble search method known as Temperature Replica Exchange Monte Carlo.
135 DPs), we first combined implicit solvent and replica exchange sampling to calculate atomistic disorde
136 ational ensemble determined from multiplexed replica exchange simulations at the folding-transition t
137 r methodology involved extensive multiplexed replica exchange simulations of the target proteins with
138 ed in peptide binding, in turn verified with replica exchange simulations performed on a peptide boun
139 sing implicit solvent molecular dynamics and replica exchange simulations, we study the impact of ibu
140  the folding time distribution from all-atom replica exchange simulations.
141 fficients are determined from the short-time replica exchange simulations.
142 chnique called free energy perturbation with replica exchange solute tempering (FEP/REST).
143 cular dynamics method combined with pH-based replica exchange to determine the pK(a) values of titrat
144               The application of GNEIMO with replica exchange to the study of fasciculin conformation
145                     By combining Hamiltonian replica exchange with a finite-temperature string method
146        Here, we utilize a recently developed replica exchange with guided annealing enhanced sampling
147                          Here we adapted the replica exchange with solute tempering method to sample
148 of H4 tail with/without K16Ac was sampled by replica exchange with solute tempering, and the free ene
149  simulation method, free energy perturbation/replica exchange with solute tempering, to two modificat
150 eve the computational efficiency of ordinary replica exchange, using fewer replicas.
151 is insight, we developed a novel Hamiltonian Replica Exchange-based method "SWISH" (Sampling Water In
152 eneral tool to extract path information from replica exchange.
153 cs simulations, such as umbrella sampling or replica exchange.
154 t solvent molecular dynamics and Hamiltonian replica exchange.
155 ith a hybrid-solvent scheme and the pH-based replica-exchange (REX) protocol are applied to obtain th
156                    We test the new method in replica-exchange continuous constant pH molecular dynami
157      Traditional molecular dynamics (MD) and replica-exchange MD (REMD) simulations of the well-chara
158                                              Replica-exchange MD simulations also support CTT release
159 ndamental problem, an approach combining the replica-exchange method and umbrella sampling (REM-US) w
160                     A new, advanced sampling replica-exchange method has been developed to specifical
161 er of the PICK1-BAR domain using multiplexed replica-exchange molecular dynamics (MREMD) and canonica
162 -35) (Abeta 10-35) peptide were probed using replica-exchange molecular dynamics (REMD) simulations i
163 face forces apparatus (SFA) measurements and replica-exchange molecular dynamics (REMD) simulations o
164                    We used accurate all-atom replica-exchange molecular dynamics (REMD) simulations t
165                             Within atomistic replica-exchange molecular dynamics (REMD), we develop a
166             Extensive samplings of full-atom replica-exchange molecular dynamics and coarse-grained s
167                    Using isobaric-isothermal replica-exchange molecular dynamics and the all-atom exp
168                           Using our previous replica-exchange molecular dynamics calcium-free simulat
169                                   Based upon replica-exchange molecular dynamics data, it was found t
170                         NMR spectroscopy and replica-exchange molecular dynamics indicate that introd
171 55)) in a membrane environment determined by replica-exchange molecular dynamics simulation.
172                         Here we use all-atom replica-exchange molecular dynamics simulations in gener
173                                              Replica-exchange molecular dynamics simulations of a hig
174  Here, we have performed extensive atomistic replica-exchange molecular dynamics simulations of the s
175                                              Replica-exchange molecular dynamics simulations show tha
176 ferences, we performed microsecond timescale replica-exchange molecular dynamics simulations to sampl
177                                 Here, we use replica-exchange molecular dynamics simulations with an
178  by coarse-grained canonical and multiplexed replica-exchange molecular dynamics simulations with the
179 H3 N-terminal tail by molecular dynamics and replica-exchange molecular dynamics simulations.
180 loid beta-protein (Abeta) is investigated by replica-exchange molecular dynamics simulations.
181 ocess, loop dynamics were investigated using replica-exchange molecular dynamics that yielded conform
182  With the use of a coarse-grained model with replica-exchange molecular dynamics, a longer timescale
183 oism, differential scanning calorimetry, and replica-exchange molecular dynamics.
184 oism, differential scanning calorimetry, and replica-exchange molecular dynamics.
185 ive cellulases with free energy perturbation/replica-exchange molecular dynamics.
186                       We performed extensive replica-exchange molecular-dynamics simulations on Ala(3
187 ynamics of a beta-hairpin, using large-scale replica-exchange molecular-dynamics simulations with an
188                                 We performed replica-exchange molecular-dynamics simulations with umb
189 it (GB/SA) model of solvation, combined with replica-exchange molecular-dynamics simulations.
190                    For validation, extensive replica-exchange Monte Carlo simulations are performed o
191 placements in the crystal unit-cells through replica-exchange Monte Carlo simulations, with the phasi
192 rmational families determined by multiplexed replica-exchange simulations, from the 10th Community Wi
193                         Here, we describe a "replica-extraction-transfer" (REX) technique that overco
194 ted into electronically transparent graphene replicas, fabricated using chemical vapor deposition of
195                We develop a full microscopic replica field theory of the dynamical transition in glas
196 cuum-deposition of platinum-carbon to make a replica for examination in the transmission electron mic
197 from the tracer experiments conducted in the replica fracture illustrating the large effect that matr
198  RS2-GFP tracer experiments conducted in the replica fracture show that increasing specific discharge
199  E. coli RS2-GFP transport through the epoxy replica fracture, which capture for the first time the p
200 e analysis with different methodology of six replica from the same sample showed lowest variability (
201 ew species sequences using all the available replicas from model species.
202 erived aliphatic hydrocarbons, the petroleum-replica fuels, have emerged as promising alternatives to
203                           The resulting gold replica has a feature size that is two orders of magnitu
204 lated pKa values based on 10-ns sampling per replica have the average absolute and root-mean-square e
205   Electron microscopy renders these graphene replicas highly transparent, revealing previously unobse
206 re we report on production of such petroleum-replica hydrocarbons in Escherichia coli.
207 nvestigate this, we combined freeze-fracture replica immunogold labeling of Cav2.1 channels, local [C
208 xin36 immunofluorescence and freeze-fracture replica immunogold labeling revealed a large variability
209                              Freeze-fracture replica immunogold labeling revealed the presence of the
210  microscopy, and grid-mapped freeze-fracture replica immunogold labeling, 10 close appositions reveal
211                                        Using replica immunogold labeling, here we show that all CA1 P
212                                           EM replica immunogold labeling, however, demonstrated only
213 ortical activity to control a mechanized arm replica in a self-feeding task.
214  and occurs autonomously, with the number of replicas increasing exponentially over time without the
215 oint distribution of the composite system of replicas is the normalized sum of the symmetrized produc
216 nuclei by a highly sensitive freeze-fracture replica labeling technique.
217 to create arrays of individually addressable replica microbial cultures.
218                                            A replica molded polydimethylsiloxane (PDMS) microfluidic
219 dual functions of barbs were reproduced with replica molded synthetic polyurethane quills.
220                             This method uses replica-molded transparent polymer parts to create minia
221 ion polymers, and can be used as masters for replica molding
222 hylene glycol) (PEG) microparticles based on replica molding (RM) for highly uniform and robust nucle
223  in thin rubber sheets were fabricated using replica molding and were subjected to stretching, foldin
224 ns on gold-coated and glass substrates; (ii) replica molding for fabrication of microfluidic devices
225                                   During the replica molding process, a uniaxial force is applied to
226 tolithography and requires no silicon wafer, replica molding, and plasma bonding like microfluidic de
227                                Here, we used replica molecular-dynamics simulations and network theor
228            The platform was fabricated using replica moulding technology in PDMS patterned by high-as
229                        We applied the single-replica multiple-state transition-interface sampling met
230 ed as masters for the fabrication of inverse replica nanochannels in a special formulation of PDMS.
231 im here was to conduct a multicentre, 1 year replica of a clinical trial in patients with one of four
232 ve infection, a retrovirus must insert a DNA replica of its genome into host cell chromosomal DNA.
233 ntative of the experimental data after 60 ns/replica of simulation time.
234 atural rock fracture and a transparent epoxy replica of that same fracture.
235 ith hydrofluoric acid yields a free-standing replica of the internal and external native frustule mor
236 sults strongly suggest that BT cells carry a replica of the motor command.
237  TP53 gene sequences has offered a humanized replica of the TP53 gene in a murine genetic environment
238                                A gold-coated replica of this surface elicited an optical response tha
239 tants with lower adaptabilities) to multiple replicas of a regimen of positive selection and then det
240 components and with functionalized polymeric replicas of biofilm microstructure.
241                                        Eight replicas of cheese were produced and a total of 48 chees
242 lysis to form electrically conductive carbon replicas of complete organisms.
243 hain reaction (PCR) is performed to transfer replicas of desired STR targets from the single-cell gen
244  and maxillary master casts, and eight stone replicas of each master cast were produced.
245 that brain systems create and use inhibitory replicas of excitatory representations for important cog
246 rotextured films, 3D shapes, and metal oxide replicas of natural biotextures.
247  it remains a challenge to create artificial replicas of natural photonic structures.
248  be restabilized via formation of inhibitory replicas of newly formed excitatory connections.
249 espite the overall fitness differences, some replicas of one mutant strain at passage 50 showed fitne
250 uch-based responses, we used both biomimetic replicas of petal surfaces and isogenic Antirrhinum line
251 iffractive optical effects produced by epoxy replicas of petals with folded cuticles persist and indu
252                 Here, we report on pyritized replicas of the iconic autotrophic Gunflintia-Huroniospo
253 zed in vitro generating nanopatterned silica replicas of the microring structures.
254 unction given by a sum of a finite number of replicas of the original cost function, with a constrain
255 eal that regenerated limbs are high fidelity replicas of the originals even after repeated amputation
256   TAML activators are exceptional functional replicas of the peroxidases and cytochrome P450 oxidizin
257  models were assessed by simulating multiple replicas of the phase III studies.
258                              Freeze-fracture replicas of the PM of Orai1-transfected cells showed ext
259                   The idea is to run several replicas of the system in parallel at different temperat
260 pic colloid particles fabricated as negative replicas of the target cells which involve templating of
261 d with a set of organic molecules, for which replicas of their (1)H NMR spectra were generated.
262 are (preprocessing, simultaneous analysis of replicas, of different conditions, ROI calculation, mult
263 erature oxidative calcination to form silica replicas or reductive pyrolysis to form electrically con
264 EBMetaD does not require multiple simulation replicas or the introduction of Lagrange multipliers, an
265 lecular dynamics with extensive sampling (16 replicas per sequence and 600 ns per replica), we invest
266                                  The silicon replicas possessed a high specific surface area (>500 m(
267  electrodeposited gold nanowires in a master-replica process and characterized with scanning electron
268  double LPNE fabrication method, this master-replica process was also used to create a large two-dime
269  model approach assimilates information from replica QMM assays, improving reliability and inter-assa
270 nected pore space, ordered mesoporous carbon replicas serve as conceptually attractive materials for
271  observables, the ensembles of more than two replicas show larger orientational variations similar to
272                                     Multiple replica simulations of ATP-, ADP-, and inhibitor-bound s
273  nucleic acid backbone that are added in the replica simulations to promote transitions of the most c
274 lm or agar culture; the metabolites are then replica "stamped" onto the NIMS surface.
275 are able to show the unbiased folding of all replicas starting from extended conformations.
276 us HCl followed by 5% H2O2 yielded a titania replica that retained the morphology of the parent HKUST
277  biofilms that consume the embryo but form a replica that retains cell organization and morphology, a
278                                      For all replicas, the 3D optical method showed small standard de
279  basic parameters of RE (e.g., the number of replicas, the RE rate, and the temperature spacing) all
280 pling theory, density functional theory, and replica theory, all miss this crucial element.
281            By bringing together results from replica theory, cavity reconstruction, void percolation,
282 s (REMD) simulations on the microseconds-per-replica timescale are used to characterize the structura
283 th transmission electron microscopy of metal replicas to locate proteins on the landscape of the cell
284  on the order of hundreds of nanoseconds-per-replica toward ensembles that yield good agreement with
285 uperresolution light microscopy and platinum replica transmission electron microscopy (TEM) to determ
286 osites (CSCs) and their conversion to silica replicas using mammalian cells as scaffolds to direct co
287  forms a hairpin is performed for 226 ns per replica, using 52 replicas.
288 pumping reveal energy-gain and -loss Floquet replica valence bands that appear instantaneously in con
289                                         Each replica was scanned 10 times with a 3D optical system, a
290                                     The PDMS replica was then oxygen plasma-bonded to a glass substra
291 rfaces or on flexible, inexpensive polymeric replicas was discovered.
292 the original repetitive waveforms into fewer replica waveforms.
293 ing (16 replicas per sequence and 600 ns per replica), we investigate the structure of the monomeric
294                          Microporous titania replicas were made from the MOF template HKUST-1 by dehy
295                                  The silicon replicas were photoluminescent, and exhibited rapid chan
296                                 The modified replicas were then scanned 10 times, and 3D datasets wer
297 n in electron micrographs of freeze-fracture replicas with periodicities of 16 and 12 nm, respectivel
298                         These include scaled replicas with sub-100-nm-level control of feature sizes
299 (III)-TAML activators as miniaturized enzyme replicas with the potential to greatly expand the techno
300                       On average, one of two replicas yielded positive growth with 2.5% NaOCl and one

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