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- Currently displaying 23041 - 23060 of 31133 publications
Sectorization of a Lamellar polymer crystal studied by dynamic Monte Carlo simulations
Macromolecules
(2003)
36
549
(doi: 10.1021/ma025853l)
A computational and experimental search for polymorphs of parabanic acid – a salutary tale leading to the crystal structure of oxo-ureido-acetic acid methyl ester
CrystEngComm
(2003)
5
3
(doi: 10.1039/b211784c)
Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes
New Journal of Chemistry
(2003)
27
365
(doi: 10.1039/b208686g)
Calculation of the melting point of NaCl by molecular simulation
The Journal of Chemical Physics
(2003)
118
728
(doi: 10.1063/1.1522375)
RELAXATION OF HCL(UPSILON = 1) AND DCL(UPSILON = 1) BY CL AND O ATOMS
IEEE Journal of Quantum Electronics
(2003)
11
695
(doi: 10.1109/JQE.1975.1068742)
Self-consistent determination of the transition state for protein folding: application to a fibronectin type III domain.
Proceedings of the National Academy of Sciences of the United States of America
(2003)
100
394
(doi: 10.1073/pnas.232704999)
Vibrational relaxation of carbon monoxide (4 ≤ v ≤ 11) at 85 K
IEEE Journal of Quantum Electronics
(2003)
QE 9
196
(doi: 10.1109/JQE.1973.1077350)
Vibrational relaxation in potentially reactive collisions: Temperature and isotope effects
IEEE Journal of Quantum Electronics
(2003)
11
696
(doi: 10.1109/JQE.1975.1068699)
Structures and thermodynamic phase transitions for oxygen and silver oxide phases on Ag{1 1 1}
Chemical Physics Letters
(2003)
367
344
A convenient method for the synthesis of dehydroquinic acid
Synthetic Communications
(2003)
33
527
(doi: 10.1081/scc-120015805)
A tilt-dependent diffusional potential energy landscape: benzyne on Ir{1 0 0}
Chemical Physics Letters
(2003)
367
116
A novel silica catalysed stereoselective cyclic carbamate and carbonate rearrangement
Chemical Communications
(2003)
1650
(doi: 10.1039/b303791f)
Development of beta-keto 1,3-dithianes as versatile intermediates for organic synthesis
Organic & biomolecular chemistry
(2003)
1
15
(doi: 10.1039/b208982c)
Site-specific cleavage of human telomerase RNA using PNA-neocuproine·Zn( ii ) derivatives
Chemical communications (Cambridge, England)
(2003)
9
36
(doi: 10.1039/b210135a)
Energy Landscapes
(2003)
A 2,3-butanedione protected chiral glycine equivalent—a new building block for the stereoselective synthesis of enantiopure N-protected α-amino acids
Chemical Communications
(2003)
3
468
(doi: 10.1039/b210673f)
Ab initio study of rearrangements between C60 fullerenes
Chem. Phys. Lett.
(2003)
374
125-131
The free energy landscape and dynamics of met-enkephalin
J. Chem. Phys.
(2003)
119
9947-9955
Stationary points and dynamics in high-dimensional systems
J. Chem. Phys.
(2003)
119
12409-12416
Theoretical study of finite-temperature spectroscopy in CaAr$_n$ clusters. II. Time-dependent absorption spectra
J. Chem. Phys.
(2003)
118
8754-8762
