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1 activation of ion translocation and not the energy of activation.
2 und thiamin diphosphate by reducing the free energy of activation.
3 inking rhodopsin significantly decreased the energy of activation.
4 states contributes significantly to the free energy of activation.
5 by 13 eu, and therefore with a similar free energy of activation.
6 m mechanically calculated aqueous phase free energies of activation.
7 ignificantly lower the computed overall free energies of activation.
8 roach based on Bell's formula, but also free energies of activation.
9 tion is unlikely on the basis of unfavorable energies of activation.
10 NAC criteria were associated with the lowest energies of activation.
11 nsition-state analogues cannot capture large energies of activation.
12 s) displays an approximately 2.5-fold higher energy of activation (152 kJ/mol) compared with that obs
13 s show that 1) both processes require a free energy of activation; 2) unfolding is kinetically enthal
14 -5-p-tolyl-1,3(Z)-pentadiene has a corrected energy of activation 5.8 kcal mol(-)(1) lower than that
15 nential Arrhenius factors, and a significant energy of activation all suggest vibrationally enhanced
16 ns between the theoretically calculated free energies of activation and kexp for 31 reactions of Cl(*
18 tion of receptor activation in terms of free energies of activation, and generate mathematical predic
19 culate rate constants, phenomenological free energies of activation, and primary and secondary kineti
20 E = S), and +21 (M = Mo, E = S) and the free energies of activation are calculated to be deltaG() = +
21 opic and enthalpic contributions to the free energies of activation are found for both classes of sub
25 arsenate from uncharged bidentate complexes, energies of activation as high as 167 kJ/mol were encoun
27 VDZ//(U)M06-2X/cc-pVDZ level of theory, free energies of activation (at 1000 degrees C) range from ca
28 ity is demonstrated, based on competing free energy of activation barriers for the elongation and ter
31 hat the various substituents affect the free energy of activation, Delta G(++), for dehydrogenation.
32 sfer was identified from changes in the free energy of activation, Delta G(++), with osmotic pressure
35 rally exhibit equilibrium dynamics with free energies of activation (DeltaG(double dagger)) for the s
38 the various substrates, we computed the free energy of activation (DeltaG()) for the cycloaddition an
40 rameters for the kinetic process gave a free energy of activation (DeltaG) of 19.3 +/- 1.2 kcal mol(-
46 indicates that 80% of the reduction in free energy of activation effected by TrpRS arises from prote
48 rom these curves, the rate constants and the energies of activation for association (k(on), E(on)) an
49 rom these curves, the rate constants and the energies of activation for association (kon, Eon) and di
50 ion can be attributed to the high Gibbs free energies of activation for forming and breaking bonds wi
52 kcat/KM measurements, the difference in free energies of activation for Suc-AAPX-pna when X is Lys+ a
58 ion calculations yielded differences in free energies of activation for the two polar protic solvents
62 ect to lower stress, and would have a higher energy of activation for autolysis than chains aligned c
66 the case of these latter reactions, the free energy of activation for cyclopropanation tends to decre
67 nnulated norbornadienone, for which the free energy of activation for decarbonylation was a remarkabl
77 ing an Arrhenius plot, the value of the free energy of activation for racemization and deuterium exch
82 the isolobal analogue Os(PH3)3H reduces the energy of activation for the rearrangement to 23 kcal/mo
83 roup along with nitrogen extrusion; the free energy of activation for this concerted process is only
84 is buried more in the surface, and the free energy of activation for this reaction is most similar t
85 NACs to NACs does not contribute to the free energy of activation from preorganization of the substra
91 ed chlorine kinetic isotope effects and free energies of activation in the wild-type and the Phe172Tr
93 tion for dynamic reasons, and its Gibbs free energy of activation is 19.3 kcal/mol and remains higher
94 s the same trend as found for DMSO, and free energy of activation is calculated to be larger by about
96 py than the starting reactants, but the free energy of activation is dominated by a large negative TD
98 (2200 M) > 4-t-BuBnI (35 M); thus, the free energy of activation is selectively decreased for organo
100 tween the overall free energies and the free energies of activation of the reactions, due to the sign
101 nts were further employed to obtain the free energies of activation of viscous flow per mole of the s
104 er, Arrhenius analysis demonstrated that the energy of activation of ion translocation was phospholip
105 acyl-enzyme intermediate-that lower the free energy of activation of the substrate transacylation rea
107 ature ions form upon irradiation, as the low energy of activation phosphate moiety cleavage transpire
109 monodentate surface complexes had Gibbs free energies of activation ranging from 62 to 73 kJ/mol, and
110 identate, binuclear complexes had Gibbs free energies of activation ranging from 79 to 112 kJ/mol and
113 for cyclic carbonate formation has a larger energy of activation than the bimolecular enchainment pa
114 ers, the Rubisco Km for CO2 presented higher energy of activation than the maximum carboxylation rate
115 FEP calculations yielded differences in free energies of activation that well reproduce the experimen
116 y analysis of the adiabatic ET gives a Gibbs energy of activation that is equal to k B T at approxima
118 or - 0.2 s(-1), respectively, whereas their energy of activation values were 14.2, 15.5, and 18.5 kc
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