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1 rease despite its important release into the hydration water.
2 hermal activation of dynamics in its surface hydration water.
3 ue to the strong repulsion from the N(+) and hydration water.
4 of different protein secondary structures on hydration water.
5 tructure on the dynamics and distribution of hydration water.
6 each component: the macromolecule, ions, and hydration water.
7 on water, low-affinity binding released more hydration water.
8  the presence of the counterion and not just hydration water.
9 cizes protein structures in a way similar to hydration water.
10 at successfully reproduces the properties of hydration water.
11  macromolecules just follows the dynamics of hydration water.
12 bel placed at the surface and the protons of hydration water.
13 the interactions between the protein and its hydration waters.
14 l potentials does reveal a transition in the hydration water, again, no transition in the protein is
15  in line with previous experimental data for hydration water and calculations based on simple assumpt
16  We observed correlated fluctuations between hydration water and protein side chains on the time scal
17        On the other hand, we detected liquid hydration water and strong water-AFP III and water-ubiqu
18 ules, the structural and dynamic behavior of hydration water, and the flexibility and conformation st
19                      The dynamics of protein hydration water appear to be very similar in crystal and
20 detailed microscopic view on the dynamics of hydration water around a hydrophobic molecule, tetrameth
21   We show that the structure and dynamics of hydration water around an organic molecule are non-unifo
22 description of the dynamical perturbation of hydration water around green fluorescent protein in solu
23 ercooled water in nanoconfined pores, and in hydration water around proteins.
24 fferences in the dynamics of protein and its hydration water at high temperatures: on the picosecond-
25 e suppression of the protein dynamics by the hydration water at low temperatures appears to be strong
26 ynamics simulations to study the dynamics of hydration water at the surface of fibers formed by the f
27    We demonstrate ordered orientation of the hydration water at the surface of phospholipid bilayers
28 hydrophobic surfaces, proteins situate their hydration waters at the edge of a dewetting transition,
29 ion of signals corresponding to interfacial (hydration) water at low water content.
30 mperature (approximately 235 K), but protein hydration water avoids this crystallization because each
31 n rates of the hydrogen bonds they form with hydration water, become apparent.
32 ls in different media is the partitioning of hydration water between the enzyme and the bulk solvent.
33 ing the H-bonding/organization status of the hydration waters both in the unbound and the bound state
34 S-G18V: (i) how do the diffusion dynamics of hydration water change as a function of protein crowding
35 dration water, or do populations of bulk and hydration water coexist?
36                       We also assess whether hydration water compressibility determined from small co
37 ure, based on average structural features of hydration water, configurational properties of single wa
38 ations have been used to investigate protein hydration water density fluctuations as a function of pr
39 itions and providing a thermodynamic role of hydration water density fluctuations in driving hydropho
40 amics of biological macromolecules and their hydration water depends strongly on the chemical and thr
41 spectroscopy, we simultaneously measured the hydration water dynamics and protein side-chain motions
42                       We also found that the hydration water dynamics are always faster than protein
43 lecular dynamics simulations, revealing that hydration water dynamics around the core domain is signi
44 n of the experimentally observed increase in hydration water dynamics around the entire tau fiber.
45 polarization (ODNP) to probe the equilibrium hydration water dynamics at select sites on the surface
46 owder samples are appropriate for discussing hydration water dynamics in native protein environments.
47                     The observed increase in hydration water dynamics is suggested to promote fiber f
48                  Furthermore, we compare the hydration water dynamics on different polypeptides and l
49                     The heterogeneity in the hydration water dynamics suggests that structured protei
50                ODNP reports on site-specific hydration water dynamics within 5-10 A of a label tether
51 we provide insight into the coupling between hydration-water dynamics and atomic motions in intrinsic
52 hought to be governed to a certain extent by hydration-water dynamics, yet it is not known whether th
53 rded due to reduced mobility of the involved hydration water, evident from a 2-fold reduction of the
54                          The dynamics of the hydration water exhibits changes at ~ 180-190 K that we
55  the picosecond-to-nanosecond timescale, the hydration water exhibits diffusive dynamics, while the p
56 s decay corresponding to fluctuations of the hydration water, followed by a significant static offset
57 imilar difference appears in the dynamics of hydration water for these biomolecules.
58 an energetic nature and due to desorption of hydration water; for larger hydration it is entropic and
59 aD (+/-0.8 per thousand) of the total gypsum hydration water from the DTIA method are comparable to t
60 f structurally-bound gypsum (CaSO(4).2H(2)O) hydration water (GHW) can be used to infer paleoclimate.
61 drated metal ion and suggests a role for the hydration water in the metal-induced conformational chan
62 re suggested to lead to a compression of the hydration water in the minor groove.
63 wding, the population of this robust surface hydration water increases, while a significant bulk-like
64 emperature range for the tau protein and its hydration water, indicating intimate coupling between th
65 ngth of the hydrogen bond network of surface hydration water is directly modulated on hydrophilic sur
66       Experimental data demonstrate that the hydration water is harmonic at temperatures <~ 180-190 K
67 al variations in thermodynamic properties of hydration water is its equilibrium dynamics spanning pic
68                     The diffusion of the GFP hydration water is similar to the behavior of hydration
69 ne --> tetrahydrofuran --> acetonitrile) the hydration water is stripped from the enzyme surface.
70                                              Hydration water is the natural matrix of biological macr
71                                              Hydration water is vital for various macromolecular biol
72 rfactant coating are similar to those of the hydration water, leading to the conclusion that the poly
73     In two studies the effects of minor hypo-hydration (water loss <1.0% of body weight) on CNS funct
74  optimal binding was associated with loss of hydration water, low-affinity binding released more hydr
75 o-strong dynamic crossover, the structure of hydration water makes a transition from predominantly hi
76 fiber formation, in particular the role that hydration water might play, remain poorly understood.
77                    Detection of the enhanced hydration water mobility around tau fibers is conjecture
78 ssment of LAURDAN's surroundings in terms of hydration, water mobility, and local electronic environm
79 ne group and the other may be related to the hydration water molecules mainly associated with the pho
80 ons of the same size and charge, anions bind hydration water more strongly.
81 t and prostate, with a higher influence from hydration water motions and localised fast rotations upo
82 udy, we conducted a site-specific probing of hydration water motions and side-chain dynamics at nine
83 ynamics simulations to explore the nature of hydration water motions at temperatures between 200 and
84 he results provide evidence that protein and hydration-water motions mutually affect and shape each o
85 e mutual influence of biomolecules and their hydration water must be taken into account.
86 r stability, the thermodynamic properties of hydration water must reflect on the properties of the he
87 irect spectroscopic observation of so-called hydration water near a peptide and yields the first quan
88 y with a significant fraction of the surface hydration water network.
89 y, from native to molten globule states, the hydration water networks loosen up, and the protein loca
90 his sudden switch in dynamic behavior of the hydration water on lysozyme occurs precisely at 220 K an
91 t polarity and indicate that the behavior of hydration water on the enzyme surface and in the active
92                                              Hydration water on the surface of a protein is thought t
93            In comparison with monomeric tau, hydration water on the surface of tau fibers is more mob
94 n occurred generating a single population of hydration water, or do populations of bulk and hydration
95 ructural changes in cell membranes and their hydration water play important functional roles.
96                            It was found that hydration water played a critical role in the formation
97  H1' in the minor groove are consistent with hydration water present that is not observed in the anal
98 ydration water is similar to the behavior of hydration water previously observed for other proteins.
99                                      Without hydration water, proteins would not fold correctly and w
100 local exclusion of F(-) and Glu(-) from this hydration water, relative to the situation with Cl(-), w
101                   We observed three types of hydration water relaxation with distinct time scales, fr
102 gly conflicting range of values reported for hydration water retardation as a logical consequence of
103 lectrostatic fluctuations of the protein and hydration water shells.
104  and solute-water attractive interactions on hydration water structure around spherical clusters of 1
105 MSO was found to effectively destabilize the hydration water structure at the lipid membrane surface
106                    The analysis reveals that hydration water suppresses protein motions at lower temp
107  directly to estimate the compressibility of hydration water surrounding proteins.
108 n be used to estimate the compressibility of hydration water surrounding proteins.
109                                          For hydration water to play a role beyond modulating global
110  Simulations reveal that phosphate displaces hydration water to promote Arg-Tyr cation-pai interactio
111 uring the collective response of the protein hydration waters to the nanoscale chemical and topograph
112 dependence on probe length demonstrates that hydration water undergoes subdiffusive motions (tau prop
113 ules prevents the crystallisation of protein hydration water upon cooling.
114 quantification of translational diffusion of hydration water using an emerging tool, (1)H Overhauser
115 ectively probing the dynamics of protein and hydration water using elastic neutron scattering and iso
116 s of green fluorescent protein (GFP) and its hydration water using neutron scattering spectroscopy an
117 d characterize their interactions with their hydration waters using molecular simulations and enhance
118 be triggered by its strong coupling with the hydration water, which also shows a similar dynamic tran
119  phase transition of DPPC concludes that the hydration water with 100-200 ps dynamics displays Arrhen
120 he phonon is coupled to a relaxation mode of hydration water with a single relaxation time of 55 +/-
121   We have also estimated the total amount of hydration water with a typical -9% deviation from experi
122 ydrated, despite the limited availability of hydration water, with both Eigen and Zundel structures c

 
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