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                             58 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 A combined experimental and theoretical study of the conformation of N,N′-diphenyl-N,N′-di(m-tolyl)benzidine using solid-state 15N NMR and DFT calculations Kaji, Hironori
2005
401 1-3 p. 246-253
8 p.
artikel
2 A 2D graphical representation of DNA sequence Liao, Bo
2005
401 1-3 p. 196-199
4 p.
artikel
3 A joint theoretical and experimental study of phenylene–acetylene molecular wires Magyar, R.J.
2005
401 1-3 p. 149-156
8 p.
artikel
4 AMBER-based hybrid force field for conformational sampling of polypeptides Kamiya, Narutoshi
2005
401 1-3 p. 312-317
6 p.
artikel
5 A partition experimental evidence of molecular complex formation of some quinones with sodium dodecyl sulphate anion in aqueous phase by spectrophotometric method Ray, Asim K.
2005
401 1-3 p. 72-75
4 p.
artikel
6 A semi-phenomenological approach to the transport and diffusion of small spherical macromolecules in solution Uvarov, Alexander
2005
401 1-3 p. 296-301
6 p.
artikel
7 Binary adsorption equilibrium of propylene and ethylene on silicalite-1: prediction and experiment Peng, Jun
2005
401 1-3 p. 94-98
5 p.
artikel
8 Calculation of the enthalpies of formation for transition metal complexes Cundari, Thomas R.
2005
401 1-3 p. 58-61
4 p.
artikel
9 Computational methods for protein design and protein sequence variability: biased Monte Carlo and replica exchange Yang, Xi
2005
401 1-3 p. 205-210
6 p.
artikel
10 DFT study of small bimetallic palladium–copper clusters Efremenko, Irena
2005
401 1-3 p. 232-240
9 p.
artikel
11 Dynamic alignment of CH3I by strong picosecond laser pulses Kaziannis, S.
2005
401 1-3 p. 115-121
7 p.
artikel
12 Editorial board 2005
401 1-3 p. IFC-
1 p.
artikel
13 Electron attachment to monomeric and dimeric forms of glycolaldehyde Ptasińska, S.
2005
401 1-3 p. 227-231
5 p.
artikel
14 Electronic spectra of intermediate charge transfer complexes of OVCl3 in argon matrices Goldberg, Nicola
2005
401 1-3 p. 89-93
5 p.
artikel
15 Entropic evidence for cooperation of multiple instabilities upon a metal–insulator transition in (EDO-TTF)2PF6 Saito, Kazuya
2005
401 1-3 p. 76-79
4 p.
artikel
16 Evidence of a shift between one- and two-photon processes associated with benzene trapped in helium nanodroplets Curtis, Sharon
2005
401 1-3 p. 254-258
5 p.
artikel
17 Examining the transition metal hydrosulfides: the pure rotational spectrum of CuSH ( X ˜ 1 A ′ ) Janczyk, A.
2005
401 1-3 p. 211-216
6 p.
artikel
18 Excited state dynamics of a PYP chromophore model system explored with ultrafast infrared spectroscopy Usman, Anwar
2005
401 1-3 p. 157-163
7 p.
artikel
19 Excited states of pigments in photosystem II reaction centers of photosynthesis: Characterization into a central dimer and remaining monomers Saito, K.
2005
401 1-3 p. 122-129
8 p.
artikel
20 Fast computation algorithm for finding stable molecular structures using network-connected computers Okuno, Yoshishige
2005
401 1-3 p. 35-39
5 p.
artikel
21 First-principles calculations on the role of CN precursors for the formation of fullerene-like carbon nitride Gueorguiev, G.K.
2005
401 1-3 p. 288-295
8 p.
artikel
22 Frequency stabilization of tunable infrared diode lasers for time-resolved monitoring of transient species Hanoune, B.
2005
401 1-3 p. 180-184
5 p.
artikel
23 Fundamental absorption frequency from quasi-classical direct ab initio molecular dynamics: diatomic molecule Aida, Misako
2005
401 1-3 p. 170-174
5 p.
artikel
24 High resolution X-ray photoemission of SrCu2O2 Lynch, C.C.B.
2005
401 1-3 p. 223-226
4 p.
artikel
25 Homology models of main proteinase from coronavirus associated with SARS Liu, Hsuan-Liang
2005
401 1-3 p. 24-29
6 p.
artikel
26 Hydrogen-bonding and protonation effects on the formation of charge transfer complex between para-benzoquinone and 2,6-dimethoxy phenol Bangal, Prakriti Ranjan
2005
401 1-3 p. 200-204
5 p.
artikel
27 Hydrogen-bonding interactions between 1-methylindole and alcohols Muñoz, María A.
2005
401 1-3 p. 109-114
6 p.
artikel
28 Influence of C5-methylation of cytosine on the formation of cyclobutane pyrimidine dimers Li, Xiaoyi
2005
401 1-3 p. 99-103
5 p.
artikel
29 Internal noise stochastic resonance of synthetic gene network Wang, Zhiwei
2005
401 1-3 p. 307-311
5 p.
artikel
30 Interplay between π–π interactions and the H-bonding ability of aromatic nitrogen bases Mignon, Pierre
2005
401 1-3 p. 40-46
7 p.
artikel
31 Memory effects in Brownian dynamics simulations of ion transport Baştuğ, Turgut
2005
401 1-3 p. 175-179
5 p.
artikel
32 Model studies of spectral and photophysical characteristics of donor-acceptor-polyenes: dimethylamino-cyano-diphenylbutadiene El-Gezawy, Hani
2005
401 1-3 p. 140-148
9 p.
artikel
33 Molecular dynamics simulation of lithium iodide in liquid dimethylsulfoxide Onthong, Usa
2005
401 1-3 p. 217-222
6 p.
artikel
34 Monte Carlo simulations of flexible molecules in a static electric field: electric dipole and conformation Poulain, P.
2005
401 1-3 p. 1-6
6 p.
artikel
35 OD ESR detection of the radical anions of cyclic nitrones in liquid solutions Barlukova, M.M.
2005
401 1-3 p. 62-67
6 p.
artikel
36 On line shape measurement and simulation of rovibrational transitions of water vapour in the near infrared region Bandyopadhyay, Amitava
2005
401 1-3 p. 135-139
5 p.
artikel
37 On the magnetic susceptibility of polyaniline – an alternative approach Petr, A.
2005
401 1-3 p. 130-134
5 p.
artikel
38 pH dependent binding of chlorin-p6 with phosphatidyl choline liposomes Das, K.
2005
401 1-3 p. 185-188
4 p.
artikel
39 Phosphorescence of individual horseradish peroxidases proteins having a modified heme group Mei, Erwen
2005
401 1-3 p. 30-34
5 p.
artikel
40 Photo-dynamics on thin silver films Jacobson, Michele L.
2005
401 1-3 p. 52-57
6 p.
artikel
41 Photoelectron spectroscopy of titanium–benzene cluster anions Zheng, Weijun
2005
401 1-3 p. 266-270
5 p.
artikel
42 Relativistic density functional theory study on the structure and bonding of U(IV) and Np(IV) hydrates Tsushima, Satoru
2005
401 1-3 p. 68-71
4 p.
artikel
43 Ring-current signatures in shielding-density maps Soncini, A.
2005
401 1-3 p. 164-169
6 p.
artikel
44 Semiempirical molecular dynamics investigation of the excited state lifetime of ethylene Barbatti, M.
2005
401 1-3 p. 276-281
6 p.
artikel
45 Solubility of Mo6S4.5I4.5 nanowires Nicolosi, Valeria
2005
401 1-3 p. 13-18
6 p.
artikel
46 Solvated electron in ( H 2 O ) 20 - dodecahedral cavity: calculated stretch frequencies and vertical dissociation energy Khan, Arshad
2005
401 1-3 p. 85-88
4 p.
artikel
47 Spectroscopic characterisation of crystal violet inclusion complexes in β-cyclodextrin García-Río, L.
2005
401 1-3 p. 302-306
5 p.
artikel
48 Spin-polarized electron current from Mn-doped closed zigzag GaN nanotubes Hao, Shaogang
2005
401 1-3 p. 47-51
5 p.
artikel
49 Synthesis and characterization of monodisperse silica colloids loaded with superparamagnetic iron oxide nanoparticles Im, Sang Hyuk
2005
401 1-3 p. 19-23
5 p.
artikel
50 The asymmetric nature of charge transfer states of the cyano-substituted proton sponge Szemik-Hojniak, A.
2005
401 1-3 p. 189-195
7 p.
artikel
51 Theoretical study of chemical compounds formed by insertion of rare gas atoms into glycine molecule: a step towards bio-rare gas chemistry? Chaban, Galina M.
2005
401 1-3 p. 318-322
5 p.
artikel
52 The outer valence orbital momentum profiles of thiophene by electron momentum spectroscopy Zhang, S.F.
2005
401 1-3 p. 80-84
5 p.
artikel
53 The ring-current model of the paratropic pentalene molecule Cuesta, I. Garcı́a
2005
401 1-3 p. 282-287
6 p.
artikel
54 The rotational spectrum of the 3,3-dimethyloxetane⋯hydrogen chloride complex Sánchez, Raquel
2005
401 1-3 p. 259-265
7 p.
artikel
55 The study of deposited silver particulate films by simple method for efficient SERS Fang, Jinghuai
2005
401 1-3 p. 271-275
5 p.
artikel
56 The surface sites of sulfated zirconia studied in situ by laser-induced fluorescence spectroscopy Chen, Jun
2005
401 1-3 p. 104-108
5 p.
artikel
57 Validation of a computational scheme to study 15N and 13C nuclear shielding constants Mothana, Belquis
2005
401 1-3 p. 7-12
6 p.
artikel
58 Visible photon cascade emission from the high energy levels of Er3+ Peijzel, P.S.
2005
401 1-3 p. 241-245
5 p.
artikel
                             58 gevonden resultaten
 
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