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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
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
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
26 plex using NMR residual dipolar couplings in replica-averaged metadynamics simulations, we observe tw
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
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
40 k between telomeric loops shared by template-replica chromatids is conceptualized in terms of homotop
42 placement are consistent with a recent exact replica computation for d = infinity, whereas some obser
50 constant-pH molecular dynamics with pH-based replica exchange (pH-REX) to gain insight into the struc
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
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
61 ns of conventional MD, as well as 160 ns of replica exchange MD (REMD), with the GLYCAM06 force fiel
64 namics (MD) simulations, our method combines replica exchange MD with transition path theory (TPT) to
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
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
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
82 -resolution model with umbrella sampling and replica exchange molecular dynamics and performed altoge
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.
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
93 xchange molecular dynamics method performs a replica exchange molecular dynamics simulation along pep
95 lected CTFs [Abeta(x-42); x=29-31, 39] using replica exchange molecular dynamics simulations and ion
98 nal switch via extensive atomically detailed replica exchange molecular dynamics simulations in expli
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
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
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
120 ulations on NCBD to date: we use large-scale replica exchange molecular dynamics to explore the unbou
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
130 en coupled with a simple energy function and replica exchange Monte Carlo simulation, our CNF method
132 lymer lattice model and stochastic sampling (replica exchange Monte Carlo) for canonical ensemble sim
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
143 cular dynamics method combined with pH-based replica exchange to determine the pK(a) values of titrat
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
151 is insight, we developed a novel Hamiltonian Replica Exchange-based method "SWISH" (Sampling Water In
155 ith a hybrid-solvent scheme and the pH-based replica-exchange (REX) protocol are applied to obtain th
157 Traditional molecular dynamics (MD) and replica-exchange MD (REMD) simulations of the well-chara
159 ndamental problem, an approach combining the replica-exchange method and umbrella sampling (REM-US) w
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
174 Here, we have performed extensive atomistic replica-exchange molecular dynamics simulations of the s
176 ferences, we performed microsecond timescale replica-exchange molecular dynamics simulations to sampl
178 by coarse-grained canonical and multiplexed replica-exchange molecular dynamics simulations with the
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
187 ynamics of a beta-hairpin, using large-scale replica-exchange molecular-dynamics simulations with an
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
194 ted into electronically transparent graphene replicas, fabricated using chemical vapor deposition of
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 (
202 erived aliphatic hydrocarbons, the petroleum-replica fuels, have emerged as promising alternatives to
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
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
210 microscopy, and grid-mapped freeze-fracture replica immunogold labeling, 10 close appositions reveal
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
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
226 tolithography and requires no silicon wafer, replica molding, and plasma bonding like microfluidic de
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.
235 ith hydrofluoric acid yields a free-standing replica of the internal and external native frustule mor
237 TP53 gene sequences has offered a humanized replica of the TP53 gene in a murine genetic environment
239 tants with lower adaptabilities) to multiple replicas of a regimen of positive selection and then det
243 hain reaction (PCR) is performed to transfer replicas of desired STR targets from the single-cell gen
245 that brain systems create and use inhibitory replicas of excitatory representations for important cog
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
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
260 pic colloid particles fabricated as negative replicas of the target cells which involve templating of
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
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
273 nucleic acid backbone that are added in the replica simulations to promote transitions of the most c
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
279 basic parameters of RE (e.g., the number of replicas, the RE rate, and the temperature spacing) all
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
288 pumping reveal energy-gain and -loss Floquet replica valence bands that appear instantaneously in con
293 ing (16 replicas per sequence and 600 ns per replica), we investigate the structure of the monomeric
297 n in electron micrographs of freeze-fracture replicas with periodicities of 16 and 12 nm, respectivel
299 (III)-TAML activators as miniaturized enzyme replicas with the potential to greatly expand the techno
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