ライフサイエンスコーパス: solvate

1 reversible colour change to a blue methanol solvate.

2 surface, and its carboxylate group is highly solvated.

3 ike conformations that are expanded and well-solvated.

4 0(3) M(-1)), whereas E * remains fully water-solvated.

5 dicate that adsorbed ions are only partially solvated.

6 ge pore sizes (1 and 0.65 nm), from neat and solvated 1-Ethyl-3-methylimidazolium bis(trifluoromethan

7 ter molecules in excess of those required to solvate 1a, respectively.

8 bstituted derivative 3a and its acetonitrile solvate 3a.MeCN, both of which crystallize in the polar

9 R-derived H-bonding donor and acceptors that solvate a wide range of ligand polar substituent arrange

10 -epigallocatechin gallate (EGCG) as a chiral solvating agent for enantiodiscrimination of alpha-amino

11 noid (-)-EGCG, a natural product as a chiral solvating agent for the discrimination of large number o

12 a millimolar aqueous solution using a chiral solvating agent was performed.

13 is synthesized and evaluated as a chiral NMR solvating agent.

14 of thiophosphinic acid (+)-14 as the chiral solvating agent.

15 differentiation of enantiomers using chiral solvating agents (CSA) is stated.

16 l lanthanide shift reagents (CLSR) or chiral solvating agents (CSA).

17 ffective macrocycles were employed as chiral solvating agents (CSAs) to determine the enantiomeric ex

18 th other, well-known chiral derivatizing and solvating agents (e.g., Mosher's acid, Pirkle's alcohol)

19 e amines were prepared and scanned as chiral solvating agents to study molecular recognition of acids

20 sized to examine their application as chiral solvating agents with amines.

21 lphosphinothioic acid and (+)-DBTA as chiral solvating agents.

22 Multi-copy explicitly solvated all-atom molecular dynamics simulations suggest

23 Explicitly solvated, all-atom molecular dynamics simulations of the

24 TPRs), flanked on each side by an additional solvating amphipathic alpha helix.

25 Modeling both a solvated and a protonated (110) goethite surface provide

26 ) x 10(-3) S/cm (Ea = 0.19(1) cm(-1)) in its solvated and desolvated forms, respectively.

27 de of the bubble such that singlet oxygen is solvated and diffuses through the aqueous solution until

28 r presence of crowders, indicative of a well-solvated and expanded random coil under all of the condi

29 es water, whereas the hydrophilic blocks are solvated and extend into the aqueous phase.

30 neries and that their bound ligands are more solvated and flexible.

31 tions, and in particular that Cu species are solvated and mobilized by NH3 under SCR conditions.

32 eous magnetization below 80 and 26 K for the solvated and the activated solids, respectively, with ma

33 of the cationic guests balanced between the solvated and the plugging situations.

34 These results also indicate that the scCO2 solvated and transported the organic ligands to the fors

35 as the corresponding stereoinversion of both solvated and unsolvated (E)-1 --> (Z)-1 in non-THF solve

36 rmation is mediated by solid-state precursor solvates and their nature.

37 t 2.5 eV leads to one-atom caging and highly solvated anion products.

38 icles with emphasis on capturing motion in a solvated, aqueous state.

39 nce many are mixtures of aggregates, various solvates are present, and frequently new mixed aggregate

40 cture of [Na][O(2)C-1] as the bis-12-crown-4 solvate, as determined by X-ray crystallography, display

41 so observed by simply directing the spray of solvated Au(+) onto the surface of an aqueous p-nitrophe

42 1.0 nm, indicating that the electrons fully solvate before reacting through second-order recombinati

43 Single crystals of solvated beta-hematin were grown from a DMSO solution co

44 All metal-ion complexes have charge-solvated binding modes, with zwitterion (salt bridge) fo

45 both the absorbance and refractive index of solvated biomolecules over the corresponding gigahertz t

46 is based on the electronic influence of the solvated boronic acid ester unit on the 4-nitroaniline g

47 nds that are possible when a single nanodrop solvates both protonated amine groups.

48 miniscent of the structures of some gamma-CD solvates, but with added crystal stability imparted by m

49 copy to characterize four lithium phenolates solvated by a range of solvents, including N,N,N',N'-tet

50 scale of >150 A in solution and are strongly solvated by a shell of solvent molecules.

51 in which the two protonated amine groups are solvated by a single water nanodrop.

52 re investigated for diprotonated Lys-Tyr-Lys solvated by between zero and 25 water molecules.

53 to characterize divalent Mg, Ca, and Ba ions solvated by discrete numbers of water molecules in the g

54 ordered phase, cholesterol is preferentially solvated by DOPC if it is available, but if DOPC is repl

55 to characterize lithium and sodium enolates solvated by N,N,N',N'-tetramethylethyldiamine (TMEDA) an

56 The lithium enolate of tert-amylacetate solvated by N,N,N',N'-tetramethylethylenediamine (TMEDA)

57 hesion, where the carboxylic acid surface is solvated by polar solvent molecules, the shear term is n

58 laced by POPC, cholesterol is preferentially solvated by PSM.

59 res of several other lithium N-alkylanilides solvated by tetrahydrofuan are also reported.

60 was used to characterize lithium phenolates solvated by tetrahydrofuran and 1,2-dimethoxyethane.

61 has been little evidence that electrons are solvated by this approach.

62 A number of sodium enolates solvated by TMEDA or THF afford exclusively tetramers.

63 s used to characterize divalent calcium ions solvated by up to 69 water molecules.

64 perature regime, the electron affinity level solvates by 540 meV at 350 K, and below the critical tem

65 duced selectively accommodates one partially solvated C60 molecule, and molecular dynamic simulations

66 None of these solvates can be prepared as phase-pure bulk materials, b

67 complexes are generally stable relative to a solvated catalyst plus free substrate and that ring-walk

68 formed from an alkali metal anion (M(-)) and solvated cation (M(en)(3)(+)).

69 ructure for hydrocarbon oxidation by aqueous solvated cationic iron(III) hydroperoxides ((H(2)O)(n)Fe

70 quence of electrostatic interactions between solvated cations present at the outer Helmholtz plane an

71 Furthermore, a single fully solvated cellulose chain is shown to be preferentially b

72 e and the charged/polar residues to face the solvated channel pores.

73 The amide carbonyl oxygen solvates charge in both the SB and CS form of both dipep

74 To aid in the interpretation of the solvated chemical shifts, we performed ab initio quantum

75 tatic dipole moments and polarizability of a solvated chromophore, using exclusively one-photon and t

76 ative transition structures linking the tris-solvated CIPs and tetrakis-solvated SIPs were also locat

77 ecular dynamics simulations of an explicitly solvated cis-beta-methylstyrene/chloroperoxidase-Compoun

78 ,4-bis(TMS)-2-butene.(TMEDA)(2)2, internally solvated cis-dilithio-1,4-bis[bis(2-methoxyethyl)aminome

79 e decreasing stability of the compact charge-solvated cis-proline structure with increased metal ion

80 ntally indicated photoinduced process in the solvated complex is of backward CT (Fe <-- Pt).

81 e investigate the molecular structure of the solvated complex, [(NC)6Fe-Pt(NH3)4-Fe(CN)6](4-), and re

82 roscopical data and measured CT rates of the solvated complex.

83 librium geometries of explicit bis- and tris-solvated contact ion pairs (CIPs) and tetrakis-solvated

84 ographically, such as hydrate, polymorph, or solvate contamination.

85 accordion, whose dimensions depend upon the solvate content of a particular crystalline phase.

86 show that the oxidizing agent is not freely solvated copper(II) ions, but complexes of copper(II) wi

87 external morphology of the beta-hematin DMSO solvate crystals is almost indistinguishable from that o

88 late that efficient rotational motion in the solvated crystals may take advantage of long-range latti

89 contrast, ArgGly x Li(+) exists in a charge-solvated (CS) form, whereas ArgGly x M(+), M = K and Cs,

90 (I)/Cu(II) sites and dominated by mobile NH3-solvated Cu-species.

91 mation of three different single-crystalline solvates [Cu(tzc)(dpp)]n.0.5C6H14.0.5H2O (1), [Cu(tzc)(d

92 Solvated density functional theory (DFT) calculations of

93 of key experimentally identified species by solvated density functional theory calculations, this st

94 iamine-solvated monomers with their ethereal-solvated dimer counterparts was probed by using dynamic

95 amer in diethyl ether and exclusively as bis-solvated dimers with chelating diamines.

96 sults of molecular dynamics simulations of a solvated dimyristoylphosphatidylcholine bilayer using th

97 mbrane, we simulated an excess proton near a solvated DMPC bilayer at 323 K, using a recently develop

98 cross-link adduct, G[8,5-Me]T, embedded in a solvated DNA dodecamer by means of quantum mechanics/mol

99 We have recently shown that in fully solvated DNA fragments, nucleobases are particularly att

100 >80 ns molecular dynamics simulation of the solvated Double-Super Helix (DSH) model of nascent high-

101 ormation of Li2O2 in low-polarity and weakly solvating electrolyte solutions.

102 ron diffraction allow the environment of the solvated electron and liquid structure to be precisely i

103 es (n <or= approximately 56) to a more fully solvated electron at larger sizes (n >or= approximately

104 The donor and acceptor states of the solvated electron in these solutions are the initial and

105 st transfer or quantum tunneling rate of the solvated electron in these solutions which serves to mod

106 tion solvation, and it is concluded that the solvated electron itself acts as a structural template.

107 roduced by gamma-radiolysis via capture of a solvated electron, and subsequent fragmentation to the s

108 ammonia molecules surrounding the localized, solvated electron.

109 easurements at 632 nm reveal the presence of solvated electrons adjacent to the diamond after photoex

110 ongly reduced high-temperature melt can host solvated electrons and bipolarons.

111 ectrons directly into water, where they form solvated electrons and induce reduction of CO2 to CO2( -

112 Solvated electrons are powerful reagents in the liquid p

113 te that neither free metal anions, M(-), nor solvated electrons are the most stable species.

114 Solvated electrons are typically generated by radiolysis

115 2 fs), and (iii) the initial VBE (1.4 eV) of solvated electrons before significant molecular reorgani

116 Solvated electrons directly introduced into the reactant

117 are similar, but not identical, to those for solvated electrons formed in bulk water by radiolysis.

118 Here we report direct measurements of solvated electrons generated by an atmospheric-pressure

119 trated that the Rieske center was reduced by solvated electrons generated by X-ray photons; the kinet

120 or quantum tunneling dynamics for excess or solvated electrons in dilute lithium-ammonia solutions h

121 provides a low-energy pathway for generating solvated electrons in the near-interfacial region of pro

122 eous iodide ion (I(-)), a chemical source of solvated electrons.

123 nation and correlates with the production of solvated electrons.

124 direct one-electron reduction to CO2( -) by solvated electrons.

125 w temperature, when the melting acetone-gold solvate encountered the thiol molecules, due to S-H bond

126 A possible importance of amine-solvated enolates is discussed.

127 Claisen rearrangement of the resulting Et 3N-solvated enolates show higher and often complementary di

128 Ion-pair separation (IPS) of THF-solvated fluorenyl (1(C)), diphenylmethyl (2(C)), and tr

129 From these, the benzene in its solvate form acts as rotation stopper, as supported by d

130 ter at 130 degrees C for 10 days affords the solvated form of Be(12)(OH)(12)(1,3,5-benzenetribenzoate

131 hown to magnetically order below 80 K in its solvated form, with the ordering temperature decreasing

132 ess, whilst eliminating the risk of unwanted solvate formation as well as enabling control of resulti

133 Brute-force avoids co-solvated free-radicals and microwaves that are essential

134 clusters that was synthesized by compressing solvated fullerenes.

135 , we find that the most stable gas phase and solvated geometries are substantially different from the

136 ent-exchange approach for the preparation of solvated graphene frameworks as high-performance anode m

137 ting the potential of mean force between two solvated graphene sheets using molecular dynamics (MD) s

138 essible in the dimer and is not available to solvate H-bond acceptor solutes.

139 mers have exposed H-bond acceptor sites that solvate H-bond donor solutes with a similar binding affi

140 ates have exposed H-bond acceptor sites that solvate H-bond donor solutes with similar binding affini

141 es have exposed H-bond acceptor sites, which solvate H-bond donor solutes with similar binding affini

142 These novel H2 O2 solvates have high crystallographic densities (1.96 and

143 s coupled to the transfer of a proton from a solvating hexafluoro-2-propanol molecule.

144 ontrol over the amount of water available to solvate host molecules.

145 ein unfolding agrees with DeltaCp values for solvating hydrocarbon gases and disagrees with DeltaCp f

146 By complexing the solvated hydronium "Eigen" cluster [D3O(+)(D2O)3] with i

147 counteranion, which is expected to be better solvated in a HBD solvent.

148 OPC, and mixed DOPC-beta-sitosterol bilayers solvated in a vitrification solution containing glycerol

149 of long polarization chains induced by ions solvated in a water monolayer confined between graphene

150 onpolar single-walled carbon nanotube (SWNT) solvated in aqueous solutions of urea, methanol, and tri

151 in the exchange reaction were preferentially solvated in different phases by using selective cation c

152 ison the diffusion distance of (1)O(2) fully solvated in H(2)O is much shorter (~150 nm).

153 solvated in the vesicle headgroup region and solvated in the acyl chain bilayer interior, respectivel

154 te solute populations in the aqueous buffer, solvated in the vesicle headgroup region and solvated in

155 The ability of ionic liquids to solvate inorganic salts completely has to date never bee

156 Solvated interaction energy (SIE) calculated in MD simul

157 ate open metal sites from dominating sorbent-solvate interactions and possibly masking the effect of

158 Strong solvating interactions of the ionic MNPs in polar solven

159 on energy to separate the attractively bound solvated interfaces perfectly reproduces the measured 60

160 ir membrane matrixes are noncoordinating and solvate interfering ions poorly.

161 DFT calculations of solvated intermediates suggest that addition of two OH(-

162 nt at zero K but stable when compared to the solvated ion in water.

163 supercooled liquid is obtained by forming a "solvate ionic liquid" from a mixture of a stabilized org

164 for our understanding of how perturbations (solvated ions, interfaces, and confinement) might affect

165 e loosely coupled "knock-on" movement of two solvated ions.

166 he triclinic space group P1 as two different solvates [L(2)].2DMF.5C(6)H(6) (S2A) and [L(2)].2DMF.4Me

167 We show that the solvate leads to deactivation of the carbon against para

168 he triiron nitrido complex capped with a thf-solvated Li cation [((tbs)L)Fe3(mu(3)-N)]Li(thf)3.

169 is multifaceted: besides acting as selective solvating ligands for Cu(+) ions exiting the nanoparticl

170 mics simulations of a single Kv monomer in a solvated lipid membrane indicate that secondary and tert

171 A tetra-HMPA-solvated lithium cyclopentanone enolate tetramer was als

172 The solution-state structure of THF solvated lithium diisopropyl amide (LDA) in hydrocarbon

173 n attachment to ion conformers with carboxyl-solvated Lys ammonium groups results in spontaneous isom

174 nylethanethiol colloids were prepared by the solvated metal atom dispersion method.

175 Mass spectrometry (MS) showed solvated metal ions as the main ionic constituent of the

176 sfer of methonium from bulk water (partially solvated methonium state) to the CB[7] cavity (mostly de

177 ng coulombic efficiency of the corresponding solvated Mg complex electrolytes.

178 hereal solvents which act as ligands to form solvated Mg complexes, plays a significant role in enhan

179 ntum methods using explicitly and implicitly solvated models.

180 strate-free enzyme and used as restraints in solvated molecular dynamics (MD) simulations to generate

181 Moreover, fully solvated molecular dynamics calculations, performed spec

182 multidomain proteins in all-atom, explicitly solvated molecular dynamics simulations.

183 compact discrete, nonporous material hosting solvate molecules of acetone.

184 nsport, precise molecular sieving of gas and solvated molecules shows great promise as novel separati

185 distribution of molecular occupancy for well-solvated molecules, as well as anomalies due to aggregat

186 where there are very high concentrations of solvated molecules.

187 rve the concurrent formation of two distinct solvated monocarbonyl photoproducts, both of which arise

188 d dilithio dianion has been established as a solvated monomeric species using a combination of NMR an

189 The exchange of the triamine-solvated monomers with their ethereal-solvated dimer cou

190 Our analysis shows that solvated monovalent ions permeate through the selectivit

191 nsic, maximum possible electron flux through solvated MtrF of 10(4)-10(5) s(-1), consistent with rece

192 so by suppressing the thermal fluctuation of solvated Na(+) (a well-known hydrate formation inhibitor

193 The majority of DMSO molecules solvating Na(+) in concentrated solutions reduces the av

194 riers for the cleavage of this bond in fully solvated nucleotides.

195 locally invert the integrated charge of the solvated object.

196 ence of hydrophobic hydration on the size of solvated objects.

197 13)C NMR studies with a crystalline o-xylene solvate of biphenylene rotor 2 suggested a 2-fold flippi

198 e carbon dioxide evolution by using an ionic solvate of dimethoxyethane and lithium nitrate.

199 d using H3PO4/anisole to produce the anisole solvate of the API in high yield and purity.

200 g ABABAB pi-stacked architecture of the EtCN solvate of the iodo-substituted, oxobenzene-bridged bisd

201 The crystal structures of the MeCN and EtCN solvates of 2 with R = NO2 have been determined.

202 Two polymorphic hydrogen peroxide solvates of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaaz

203 l (1b, Phi = 2%) and toluene (1c, Phi = 10%) solvates of [Au(2)Cu(2)(C(2)OHC(5)H(8))(4)](n) adopt oct

204 C(4)H(10)O)); and type C, orange luminescent solvates of a polymer ({Au(mu-dppe)Br}(n).0.5(C(4)H(10)O

205 ypes of crystals: type A, orange luminescent solvates of the dimer Au(2)(dppe)(2)Br(2) (Au(2)(mu-dppe

206 ).2(HC(O)NMe(2))); type B, green luminescent solvates of the same dimer (Au(2)(mu-dppe)(2)Br(2).(NCMe

207 lock copolymers in solvents that selectively solvate one of the segments provides a promising route t

208 ed in the core suggest that the core becomes solvated only later in a late wet molten globule, IL, wh

209 ains and LC domains stayed intact to connect solvated PEO and PAA blocks, leading to a free-standing

210 It is proposed that solvated peptide ions are ejected with high kinetic ener

211 ed detonation velocities/pressures (with one solvate performing better than -CL-20), and a sensitivit

212 talline bulk material of an additional forth solvate phase [Cu(tzc)(dpp)]n.2H2O (4).

213 al representation is subtly perturbed in the solvated phase relative to the ideal gas, and its geomet

214 ory calculations, allow us to assign the two solvated photoproducts to singlet and triplet CpCo(CO)(s

215 conjugated polymers, chirality in polymers, solvating polymers, and polymerization/depolymerization

216 MD simulations predict site 20 to face the solvated pore.

217 phene frameworks exhibit unique hierarchical solvated porous networks and can be directly used as ele

218 res, and has a structure that evolves from a solvated porous state to a desolvated non-porous state a

219 are not only chemically very inert but also solvate potentially interfering ions poorly, resulting i

220 bservations and a growth model show that the solvating properties of the additives prompt a solution-

221 l to separate the dielectric response of the solvated protein from that of its buffer.

222 ained from molecular dynamics simulations of solvated protein in a water box.

223 he electrophoretic mobilities characterizing solvated proteins and demonstrate quantitative compariso

224 Thus, solvated proteins can play a key role in facilitating re

225 This bypasses the step of treating the solvated proton that most of the current theories have d

226 Furthermore, the solvated Re(I) photoproduct of CO release (2) is also lu

227 Here, we use a solvated redox indicator for in situ determination of re

228 Solvated reduced graphene oxide (S-rGO) membranes are st

229 These solvates represent an area of energetic materials that h

230 ubricant" in facilitating enhanced motion in solvated RNA molecules.

231 tact buried water molecules calculated using solvated rotamer models met with mixed success; however,

232 sured for the gaseous (S(4)+4B)(n+) ions and solvated (S(4)+4B) complex can be largely accounted for

233 One weakens a network of solvated salt bridges, whereas the other perturbs the un

234 hereas D23-K28 contacts are more probable in solvated salt bridges.

235 Although rotational exchange occurs in the solvated samples with a slightly lower barrier of 7.4 kc

236 lvated contact ion pairs (CIPs) and tetrakis-solvated separated ion pairs (SIPs) were located at B3LY

237 nanoparticles (AgNP) were created by landing solvated silver ions at desired locations using electric

238 reement with the theory, and with explicitly solvated simulations.

239 linking the tris-solvated CIPs and tetrakis-solvated SIPs were also located.

240 molecular dynamics simulations of the fully solvated SLO model using ENDOR-derived restraints give a

241 IL) electrolytes with tailored basicities to solvate SO2 by reversible chemical absorption.

242 ilico simulations, provides a unique view of solvated soft matter nanoassemblies as they morph and ev

243 ory (DFT) calculations of both gas-phase and solvated species.

244 s process, techniques capable of probing the solvated state are consequently required.

245 ng pose and end with the ligand in the fully solvated state are generated.

246 cially where dynamics are of interest in the solvated state.

247 le ATHP [M + 2H](2+) conformation at the "de-solvated" state corresponds to the AT hook motif observe

248 vent state distribution to the gas-phase "de-solvated" state distribution demonstrated that ATHP is "

249 al shifts with the experimentally determined solvated-state shifts.

250 chemical shifts between the crystalline and solvated states to changes in conformation and hydrogen

251 sampling of the target binding sites and its solvated states.

252 d nucleic acids is an integral part of their solvated structure.

253 how that human Argonaute2 (Ago2) possesses a solvated surface pocket that specifically binds adenine

254 duced that yields accurate pressures between solvated surfaces at prescribed water chemical potential

255 ctivated efficiently by shear forces both in solvated systems and in bulk materials, and the resultin

256 PITPalpha, both on membrane bilayers and in solvated systems, informed downstream biochemical analys

257 onte Carlo proposals in simulations of dense solvated systems.

258 molecular dynamics (MD) simulations of fully solvated T4 Lysozyme, labeled with the spin label MTSSL

259 azide-alkyne cycloadditions (CuAAC) between solvated terminal alkyne molecules and azide-terminated

260 if sufficient water molecules are present to solvate the Cl(-) anions.

261 relay, adding water molecules to explicitly solvate the core reaction system reduces the barrier to

262 water molecule more than what is required to solvate the epoxy alcohol.

263 esence of dodecyl phosphocholine micelles to solvate the membrane anchor of the protein and the hydro

264 dicate that all six water molecules directly solvate the metal ion.

265 lable, the hydroxyl and fluorine substituent solvate the metal ion.

266 In the EtCN solvate the radicals are dimerized, but in the MeCN solv

267 the radicals are dimerized, but in the MeCN solvate the radicals form superimposed and evenly spaced

268 Those solvents that most solvate the singlet carbene will also have the greatest

269 Phenol solvates the amide groups on the ligands strongly, incre

270 p(Ge) or 5p(Sn) orbital while a second NH(3) solvates the complexed NH(3) via intermolecular N-H...N

271 nism of anesthesia, where the anesthetic, by solvating the lipid components, profoundly changes the l

272 ng proteins and are thought to act by better solvating the unfolded state.

273 the hydrophilic residues of the peptide are solvated throughout the translocating process.

274 ional hexagonal pore structure in an organic solvate to be trapped in a binary cocrystal.

275 SlambdaD)) simulations, we have identified a solvated transient state, characterized by a partially o

276 ing of the wet molten globule and involves a solvated transition state.

277 in of the extended cage structure and hosted solvated (trapped) electrons in the C12A7 glass.

278 The examined systems comprise explicitly solvated trimeric forms of avian H3, H5, and swine H9 in

279 on transfers are suggested to involve highly solvated triple ions.

280 CO reduction in the presence of THF forms a solvated variant of 2, the ynediolate [(R(2)N)(3)Y](2)(m

281 he primary effect of DMSO is to decrease the solvated volume of the PC head group and that, from 10 m

282 in the megahertz regime for the crystalline solvate was obtained by variable-temperature quadrupolar

283 f a photochemically inactive dichloromethane solvate was used to confirm the molecular and packing st

284 interact with Arg(75) and Arg(77) and their solvate water (on thrombin).

285 of an ice-like bond which suggests that the solvated water becomes increasingly ordered with time in

286 vity filter lead to (partial) replacement of solvating water as the ion passes through the pore.

287 ogen (H)-bonding arrangement of a set of ion-solvating water molecules and the chemical activity of t

288 In addition, the dynamics of the solvating water molecules is slowed down by about a fact

289 dynamics of charged polyelectrolytes and the solvating water molecules.

290 nding on the number and configuration of the solvating waters.

291 etrameric cyclopentyllithium tetrahydrofuran solvate were determined by single-crystal X-ray diffract

292 change molecular dynamics simulations of the solvated wild-type (WT), A2V, and A2T Abeta(1)(-)(4)(2)

293 ontain bonded C4H4(+) and C6H6(+) structures solvated with one or more neutral acetylene molecules.

294 metal ions via ion evaporation of metal ions solvated with organic molecules.

295 mpared to a 250 ns simulation of the lattice solvated with pure water.

296 DFT computations with bicarbonate radicals, solvated with up to eight water molecules, predicted tha

297 nally, the trans conformation is selectively solvated within the bulk to a greater degree than is the

298 The presence of solvates within the pores of the ZIF-8 has a dramatic ef

299 Methanol-solvated ZIF-8 microcrystals are much less deformable th

300 The results suggest that the H2 O-solvated Zn(2+) possesses largely reduced effective char