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    1. Bosco, M; Miertus, S; Turchini, S; Prosperi, T; Ascone, I; Rizzo, R
      Structural studies on polygalacturonate gels: an EXAFS investigation combined with molecular modelling

      CARBOHYDRATE POLYMERS
    2. Hruby, VJ; Qiu, W; Okayama, T; Soloshonok, VA
      Design of nonpeptides from peptide ligands for peptide receptors

      G PROTEIN PATHWAYS, PT A, RECEPTORS
    3. Miwa, JH; Patel, AK; Vivatrat, N; Popek, SM; Meyer, AM
      Compatibility of the thioamide functional group with beta-sheet secondary structure: Incorporation of a thioamide linkage into a beta-hairpin peptide

      ORGANIC LETTERS
    4. Zhulina, EB; Dobrynin, AV; Rubinstein, M
      Adsorption isotherms of polyampholytes at charged spherical particles

      JOURNAL OF PHYSICAL CHEMISTRY B
    5. Counterman, AE; Clemmer, DE
      Magic number clusters of serine in the gas phase

      JOURNAL OF PHYSICAL CHEMISTRY B
    6. Melendez-Pagan, Y; Taylor, BE; Ben-Amotz, D
      Cavity formation and dipolar contribution to the gauche-trans isomerization of 1-chloropropane and 1,2-dichloroethane

      JOURNAL OF PHYSICAL CHEMISTRY B
    7. Kaukinen, U; Bielecki, L; Mikkola, S; Adamiak, RW; Lonnberg, H
      The cleavage of phosphodiester bonds within small RNA bulges in the presence and absence of metal ion catalysts

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    8. Lomas, JS; Adenier, A
      Solvent effects on hydrogen bonding and rotation barriers in alpha-alkyl-substituted 2-alkoxybenzyl alcohols

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    9. Lomas, JS
      Competing inter- and intramolecular hydrogen bonding: solvent-driven rotamerization in 3,4-(ethylenedioxy)-2-thienyldi(tert-alkyl)methanols

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    10. Basosi, R; D'Amelio, N; Gaggelli, E; Pogni, R; Valensin, G
      cis-trans Isomerization of beta-casomorphin peptides bound to copper(II): integration of EPR and NMR studies

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    11. Lee, JS; Lee, DJ; Kim, BS; Kim, K
      Reactions of thiobenzoylketene S,N-acetals with silyl enol ethers of cyclic ketones in the presence of desilylating reagents: formation and desulfurization of thienolactams

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1
    12. Scigelova, M; Green, PS; Giannakopulos, AE; Rodger, A; Crout, DHG; Derrick, PJ
      A practical protocol for the reduction of disulfide bonds in proteins prior to analysis by mass spectrometry

      EUROPEAN JOURNAL OF MASS SPECTROMETRY
    13. Eisenhardt, CG; Pietraperzia, G; Becucci, M
      The high resolution spectrum of the S-1 <- S-0 transition of anisole

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    14. Ishida, M; Takai, M; Okabayashi, H; Masuda, H; Furusaka, M; O'Connor, CJ
      Supramolecular aggregates formed by L-glutamic acid-oligomers: SANS and SAXS studies of the hydrogen bonded self-assembly

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    15. Gaggelli, E; D'Amelio, N; Gaggelli, N; Valensin, G
      Metal ion effects on the cis/trans isomerization equilibrium of proline inshort-chain peptides: A solution NMR study

      CHEMBIOCHEM
    16. Superchi, S; Casarini, D; Laurita, A; Bavoso, A; Rosini, C
      Induction of a preferred twist in a biphenyl core by stereogenic centers: A novel approach to the absolute configuration of 1,2-and 1,3-diols

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    17. Kozhushkov, SI; Kostikov, RR; Molchanov, AP; Boese, R; Benet-Buchholz, J; Schreiner, PR; Rinderspacher, C; Ghiviriga, I; de Meijere, A
      Tetracyclopropylmethane: A unique hydrocarbon with S-4 symmetry

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    18. Tuffery, P
      Exploring a hybrid space minimization procedure

      THEORETICAL CHEMISTRY ACCOUNTS
    19. Wade, JD; Catimel, B; Faux, MC; Burgess, AW; Nice, E; Otvos, L
      Structural and biosensor analyses of a synthetic biotinylated peptide probe for the isolation of adenomatous polyposis coli tumor suppressor protein complexes

      JOURNAL OF PEPTIDE RESEARCH
    20. Sedmera, P; Jegorov, A; Buchta, M; Cvak, L
      11-Demethylcyclosporins exhibit a single conformation in methanol and dimethylsulfoxide

      JOURNAL OF PEPTIDE RESEARCH
    21. Yamato, T; Iwasa, T; Zhang, FL
      Synthesis and ion selectivity of tetrakis[(N,N-dialkylaminocarbonyl) methoxy]homocalix[4]arenes

      JOURNAL OF INCLUSION PHENOMENA AND MACROCYCLIC CHEMISTRY
    22. Yamato, T; Zhang, FL
      Synthesis, conformations and inclusion properties of hexahomotrioxacalix[3]arene triamide derivatives having hydrogen-bonding groups

      JOURNAL OF INCLUSION PHENOMENA AND MACROCYCLIC CHEMISTRY
    23. Grutzmacher, HF; Zoric, S; Wellbrock, C
      Complexation of transition metal ions M+ (M = Fe, Co, Ni, Cu, Zn, Ag) by [2.n]paracyclophane-enes (n = 3, 4, 5, 6) in the gas phase: effect of the molecular cavity on the complexation capability

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    24. Jorgensen, TJD; Andersen, JU; Hvelplund, P; Sorensen, M
      High-energy collisions of multiply charged lysozyme ions in gases

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    25. Verdier, L; Gharbi-Benarous, J; Bertho, G; Mauvais, P; Girault, JP
      A novel mechanism of antibiotic resistance: study of the complex state of peptides with bacterial Staphylococcus aureus ribosomes

      COMPTES RENDUS DE L ACADEMIE DES SCIENCES SERIE II FASCICULE C-CHIMIE
    26. Vijila, C; Ramalingam, A; Palanisamy, PK; Masilamani, V
      Role of dipole moment of solvents in formation and stabilization of the TICT states in Coumarin 445 under nitrogen laser excitation

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    27. Deane, CM; Kaas, Q; Blundell, TL
      SCORE: predicting the core of protein models

      BIOINFORMATICS
    28. Egli, M; Minasov, G; Teplova, M; Kumar, R; Wengel, J
      X-ray crystal structure of a locked nucleic acid (LNA) duplex composed of a palindromic 10-mer DNA strand containing one LNA thymine monomer

      CHEMICAL COMMUNICATIONS
    29. Maji, SK; Drew, MGB; Banerjee, A
      First crystallographic signature of amyloid-like fibril forming beta-sheetassemblage from a tripeptide with non-coded amino acids

      CHEMICAL COMMUNICATIONS
    30. Tedesco, E; Harris, KDM; Johnston, RL; Turner, GW; Raja, KMP; Balaram, P
      Ab initio structure determination of a peptide beta-turn from powder X-raydiffraction data

      CHEMICAL COMMUNICATIONS
    31. Kogej, K; Cerkovnik, J; Berghmans, H; Paoletti, S
      Light scattering investigation of aqueous solutions of poly (methacrylic acid) and poly (sodium methacrylate)

      ACTA CHIMICA SLOVENICA
    32. Polson, JM; Vattulainen, I; Zhu, H; Zuckermann, H
      Simulation study of lateral diffusion in lipid-sterol bilayer mixtures

      EUROPEAN PHYSICAL JOURNAL E
    33. Bowick, MJ; Cacciuto, A; Thorleifsson, G; Travesset, A
      Universality classes of self-avoiding fixed-connectivity membranes

      EUROPEAN PHYSICAL JOURNAL E
    34. Autrey, D; Choo, J; Laane, J
      Spectroscopic determination of the ring-twisting potential energy functionof 1,3-cyclohexadiene and comparison with ab initio calculations

      JOURNAL OF PHYSICAL CHEMISTRY A
    35. Pacios, LF; Galvez, O; Gomez, PC
      Intramolecular effects and relative stabilities of conformers of gaseous glycine

      JOURNAL OF PHYSICAL CHEMISTRY A
    36. Abu-Sharkh, BF
      Glass transition temperature of poly(vinylchloride) from molecular dynamics simulation: explicit atom model versus rigid CH2 and CHCl groups model

      COMPUTATIONAL AND THEORETICAL POLYMER SCIENCE
    37. Marszalek, PE; Li, HB; Fernandez, JM
      Fingerprinting polysaccharides with single-molecule atomic force microscopy

      NATURE BIOTECHNOLOGY
    38. Ishikawa, K; Nakamura, T; Koga, Y
      Cross-checking of nanoelectrospray ionization mass spectrometry and computer simulation for the evaluation of the interaction strength of non-covalently bound enkephalins in solution

      JOURNAL OF MASS SPECTROMETRY
    39. Moret, MA; Pascutti, PG; Mundim, KC; Bisch, PM; Nogueira, E
      Multifractality, Levinthal paradox, and energy hypersurface - art. no. 020901

      PHYSICAL REVIEW E
    40. Tartaglia, M; Mehler, EL; Goldberg, R; Zampino, G; Brunner, HG; Kremer, H; van der Burgt, I; Crosby, AH; Ion, A; Jeffery, S; Kalidas, K; Patton, MA; Kucherlapati, RS; Gelb, BD
      Mutations in PTPN11, encoding the protein tyrosine phosphatase SHP-2, cause Noonan syndrome

      NATURE GENETICS
    41. Casnati, A; Giunta, F; Sansone, F; Ungaro, R; Montalti, M; Prodi, L; Zaccheroni, N
      Synthesis, complexation and photophysics of 1,3-alternate calix[4]arene-crowns-6 bearing fluorophoric units on the bridge

      SUPRAMOLECULAR CHEMISTRY
    42. Pogodin, S; Agranat, I
      Large PAHs derived from benzanthrone and naphthanthrone. A semieimpirical study

      POLYCYCLIC AROMATIC COMPOUNDS
    43. Imase, T; Kawauchi, S; Watanabe, J
      Internal rotation of ester linkage in phenyl benzoate and hydroxybenzoic acid dimer as models of aromatic polyesters using density functional theory

      MACROMOLECULAR THEORY AND SIMULATIONS
    44. Aleman, C; Green, MM
      A molecular orbital approach to conformational study of the polyisocyanates

      MACROMOLECULAR THEORY AND SIMULATIONS
    45. Xu, QB; Zou, S; Zhang, WK; Zhang, X
      Single-molecule force spectroscopy on carrageenan by means of AFM

      MACROMOLECULAR RAPID COMMUNICATIONS
    46. Kawakami, J; Nakamura, J; Iwamura, M
      Photophysical properties of beta-(1-pyrenyl)ethyl p-cyanobenzoate in binary solvents of isooctane-ethyl acetate and ethyl acetate-acetonitrile

      JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY
    47. Bousset, L; Belrhali, H; Janin, J; Melki, R; Morera, S
      Structure of the globular region of the prion protein Ure2 from the yeast Saccharomyces cerevisiae

      STRUCTURE
    48. Lindman, S; Lindeberg, G; Gogoll, A; Nyberg, F; Karlen, A; Hallberg, A
      Synthesis, receptor binding affinities and conformational properties of cyclic methylenedithioether analogues of angiotensin II

      BIOORGANIC & MEDICINAL CHEMISTRY
    49. Harrison, PM; Chan, HS; Prusiner, SB; Cohen, FE
      Conformational propagation with prion-like characteristics in a simple model of protein folding

      PROTEIN SCIENCE
    50. Hakansson, AE; Wengel, J
      The adenine derivative of alpha-L-LNA (alpha-L-ribo configured locked nucleic acid): Synthesis and high-affinity hybridization towards DNA, RNA, LNA and alpha-L-LNA complementary sequences

      BIOORGANIC & MEDICINAL CHEMISTRY LETTERS
    51. Purves, RW; Barnett, DA; Ells, B; Guevremont, R
      Gas-phase conformers of the [M+2H](2+) ion of bradykinin investigated by combining high-field asymmetric waveform ion mobility spectrometry, hydrogen/deuterium exchange, and energy-loss measurements

      RAPID COMMUNICATIONS IN MASS SPECTROMETRY
    52. Mong, TKK; Niu, AZ; Chow, HF; Wu, C; Li, L; Chen, R
      beta-alanine-based dendritic beta-peptides: Dendrimers possessing unusually strong binding ability towards protic solvents and their self-assembly into nanoscale aggregates through hydrogen-bond interactions

      CHEMISTRY-A EUROPEAN JOURNAL
    53. Flock, S; Frauenrath, H
      Aziridination of 5-methyl-4H-1,3-dioxins by N-tosyliminophenyliodinane: A one-step procedure for the synthesis of alpha-methylserinal derivatives

      SYNLETT
    54. Totani, K; Asano, S; Takao, K; Tadano, K
      Highly stereoselective alpha-alkylations, 1,4-additions, and one-pot 1,4-addition/alpha-methylations achieved on 4-O-acyl and 4-O-crotonyl derivatives of methyl 6-deoxy-2,3-di-O-(t-butyldimethylsilyl)-alpha-D-glucopyranoside

      SYNLETT
    55. Volter, KE; Embrey, KJ; Pierens, GK; Quinn, RJ
      A study of the binding requirements of calyculin A and dephosphonocalyculin A with PP1, development of a molecular recognition model for the binding interactions of the okadaic acid class of compounds with PP1

      EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES
    56. Peti, W; Smith, LJ; Redfield, C; Schwalbe, H
      Chemical shifts in denatured proteins: Resonance assignments for denaturedubiquitin and comparisons with other denatured proteins

      JOURNAL OF BIOMOLECULAR NMR
    57. Nguyen, HP; Seto, NOL; Brade, L; Kosma, P; Brade, H; Evans, SV
      Crystallization and preliminary X-ray diffraction analysis of two homologous antigen-binding fragments in complex with different carbohydrate antigens

      ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY
    58. Zucchi, C; Tiddia, S; Boese, R; Tschoerner, CM; Bencze, L; Palyi, G
      Carbohydrate-derived alkylcobalt carbonyl: {[(1,2 : 5,6-di-O,O-isopropylidene-alpha-D-glucofuranos-3-yl)oxycarbonyl]methyl}cobalt tricarbonyl triphenylphosphine

      CHIRALITY
    59. Gauvin, J; Broyde, S; Shapiro, R
      The food mutagen 2-amino-3,8-dimethylimidazo[4,5-f]quinoxaline: A conformational analysis of its major DNA adduct and comparison with the 2-amino-3-methylimidazo[4,5-f]quinoline adduct

      CHEMICAL RESEARCH IN TOXICOLOGY
    60. Song, HH; Cho, TY; Heberer, DP; Dang, TD; Arnold, FE; Tan, LS
      Poly(2,5-dihydroxy-1,4-phenylene benzobisthiazole)/poly(1,4-phenylene benzobisthiazole) copolymers: Chain packing and properties

      JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS
    61. Kamei, H; Shimazaki, K; Nishi, Y
      Computational 3-D modeling and site-directed mutation of an antibody that binds Neu2en5Ac, a transition state analogue of a sialic acid

      PROTEINS-STRUCTURE FUNCTION AND GENETICS
    62. Calimet, N; Schaefer, M; Simonson, T
      Protein molecular dynamics with the generalized Born/ACE solvent model

      PROTEINS-STRUCTURE FUNCTION AND GENETICS
    63. Forcellino, F; Derreumaux, P
      Computer simulations aimed at structure prediction of supersecondary motifs in proteins

      PROTEINS-STRUCTURE FUNCTION AND GENETICS
    64. Schueler-Furman, O; Altuvia, Y; Margalit, H
      Examination of possible structural constraints of MHC-binding peptides by assessment of their native structure within their source proteins

      PROTEINS-STRUCTURE FUNCTION AND GENETICS
    65. Garcia, AE; Sanbonmatsu, KY
      Exploring the energy landscape of a beta hairpin in explicit solvent

      PROTEINS-STRUCTURE FUNCTION AND GENETICS
    66. Kochneva-Pervukhova, NV; Chechenova, MB; Valouev, IA; Kushnirov, VV; Smirnov, VN; Ter-Avaneysan, MD
      [PSI+] prion generation in yeast: characterization of the 'strain' difference

      YEAST
    67. Abraham, RJ; Bedford, GR; Canton, M; Leonard, P
      Complete analysis of the H-1 NMR spectra of bicyclo[3.2.0]hept-2-en-6-one and the 7,7-dimethyl, 7,7-dichloro and 7-endo-chloro derivatives

      MAGNETIC RESONANCE IN CHEMISTRY
    68. Janke, EMB; Dunger, A; Limbach, HH; Weisz, K
      Hydrogen bonding in complexes of adenosine and 4-thiouridine: a low-temperature NMR study

      MAGNETIC RESONANCE IN CHEMISTRY
    69. Dao, TT; Archer, LA
      Relaxation dynamics of entangled polymer liquids near solid substrates

      LANGMUIR
    70. Dwyer, DS
      Electronic properties of the amino acid side chains contribute to the structural preferences in protein folding

      JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
    71. Richard, T; Verge, S; Berke, B; Vercauteren, J; Monti, JP
      NMR and simulated annealing investigations of bradykinin in presence of polyphenols

      JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
    72. Bury, Y; Herdick, M; Uskokovic, MR; Carlberg, C
      Gene regulatory potential of 1 alpha,25-dihydroxyvitamin D-3 analogues with two side chains

      JOURNAL OF CELLULAR BIOCHEMISTRY
    73. Williams, BD; Williams, B; Bernardoni, F; Finn, RC; Zubieta, J
      Synthesis of 3-azabicyclo[3.3.1]nonane-6,9-diones

      HETEROCYCLES
    74. de Pablo, JJ; Ottinger, HC
      An atomistic approach to general equation for the nonequilibrium reversible-irreversible coupling

      JOURNAL OF NON-NEWTONIAN FLUID MECHANICS
    75. Kumar, TV; Singh, TC; Veeraiah, T; Venkateshwarlu, G
      Molecular complexes of DDQ with N-benzylideneanilines

      INDIAN JOURNAL OF CHEMISTRY SECTION A-INORGANIC BIO-INORGANIC PHYSICAL THEORETICAL & ANALYTICAL CHEMISTRY
    76. Babu, VVS; Ananda, K
      Zinc promoted rapid and efficient synthesis of Fmoc- and Z-alpha,alpha-dialkylamino acids under neutral conditions

      INDIAN JOURNAL OF CHEMISTRY SECTION B-ORGANIC CHEMISTRY INCLUDING MEDICINAL CHEMISTRY
    77. Zeng, XS; Weng, LH; Zhang, ZZ
      The first lower-rim O-arylation of calix[4]arenes

      CHEMISTRY LETTERS
    78. Takagi, Y; Warashina, M; Stec, WJ; Yoshinari, K; Taira, K
      Recent advances in the elucidation of the mechanisms of action of ribozymes

      NUCLEIC ACIDS RESEARCH
    79. Badia, M; Benhamou, M; Derouiche, A; Bretonnet, JL
      Determination of the amplitude of the repulsive-pair potential between particles clothed by end-grafted polymers

      COLLOID AND POLYMER SCIENCE
    80. Elstner, M; Jalkanen, KJ; Knapp-Mohammady, M; Frauenheim, T; Suhai, S
      Energetics and structure of glycine and alanine based model peptides: Approximate SCC-DFTB, AM1 and PM3 methods in comparison with DFT, HF and MP2 calculations

      CHEMICAL PHYSICS
    81. Johansson, J
      Membrane properties and amyloid fibril formation of lung surfactant protein

      BIOCHEMICAL SOCIETY TRANSACTIONS
    82. Song, MS; Shao, HY; Mujeeb, A; James, ML; Miller, WL
      Molten-globule structure and membrane binding of the N-terminal protease-resistant domain (63-193) of the steroidogenic acute regulatory protein (StAR)

      BIOCHEMICAL JOURNAL
    83. Staniforth, RA; Giannini, S; Higgins, LD; Conroy, MJ; Hounslow, AM; Jerala, R; Craven, CJ; Waltho, JP
      Three-dimensional domain swapping in the folded and molten-globule states of cystatins, an amyloid-forming structural superfamily

      EMBO JOURNAL
    84. Birkett, CR; Hennion, RM; Bembridge, DA; Clarke, MC; Chree, A; Bruce, ME; Bostock, CJ
      Scrapie strains maintain biological phenotypes on propagation in a cell line in culture

      EMBO JOURNAL
    85. Rajnikant; Gupta, VK; Khan, EH; Shafi, S; Firoz, J; Shafiullah; Gupta, R
      Crystal structure of 6-nitro-cholest-5-ene

      CRYSTAL RESEARCH AND TECHNOLOGY
    86. Prusis, P; Muceniece, R; Mutule, I; Mutulis, F; Wikberg, JES
      Design of new small, cyclic melanocortin receptor-binding peptides using molecular modelling: Role of the His residue in the melanocortin peptide core

      EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
    87. Mohle, K; Hofmann, HJ; Thiel, W
      Description of peptide and protein secondary structures employing semiempirical methods

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    88. Tang, P; Zubryzcki, I; Xu, Y
      Ab initio calculation of structures and properties of halogenated general anesthetics: Halothane and sevoflurane

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    89. Hartmann, H; Bongers, A; Decker, H
      Small-angle neutron scattering reveals an oxygen-dependent conformational change of the immunogen keyhole limpet hemocyanin type 1 (KLH1)

      EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS
    90. Vorlickova, M; Kejnovska, I; Tumova, M; Kypr, J
      Conformational properties of DNA fragments containing GAC trinucleotide repeats associated with skeletal displasias

      EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS
    91. Breza, M; Lukes, V; Vrabel, I
      On the dependence of optical properties on conformational changes in oligothiophenes I. Electron absorption spectra

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    92. Villagra, SE; Santillan, MB; Rodriguez, AM; Chasse, GA; Freile, ML; Zacchino, S; Matyus, P; Enriz, RD
      Dynamic chirality in selected diaryl methane containing drugs. An exploratory ab initio conformational study

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    93. Barroso, MN; Cerutti, ES; Rodriguez, AM; Jauregui, EA; Farkas, O; Perczel, A; Enriz, RD
      Side-chain conformations for selected backbone conformations of N-acetyl-L-isoleucine-N-methylamide and N-acetyl-L-norisoleucine-N-methylamide. An exploratory ab initio study

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    94. Bombasaro, JA; Suvire, FD; Chasse, GA; Zamarbide, GN; Estrada, MR
      Stereoelectronic effects and dynamic chirality in ethyl nitrite (Et-ONO) computed at the HF and DFT levels of theory

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    95. Tarditi, AM; Klipfel, MW; Rodriguez, AM; Suvire, FD; Chasse, GA; Farkas, O; Perczel, A; Enriz, RD
      An ab initio exploratory study of side chain conformations for selected backbone conformations of N-acetyl-L-glutamine-N-methylamide

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    96. Kortvelyesi, T; Kiss, G; Murphy, RF; Penke, B; Lovas, S
      Effect of Ala-substitution, N- and C-terminal modification and the presence of counter ions on the structure of amyloid peptide fragment 25-35

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    97. Masman, MF; Amaya, MG; Rodriguez, AM; Suvire, FD; Chasse, GA; Farkas, O; Perczel, A; Enriz, RD
      An exploratory study of side-chain-backbone interaction in selected conformations of N-acetyl-L-glutamate-N-methylamide. An ab initio study

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    98. Garduno-Juarez, R; Morales, LB; Flores-Perez, P
      About singularities at the global minimum of empiric force fields for peptides

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    99. Benassi, R; Bertarini, C; Taddei, F; Kleinpeter, E
      Exocyclic push-pull conjugated compounds. Part 4. rotational barriers in poorly polarized push-pull ethylenes

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    100. Zamora, MA; Baldoni, HA; Bombasaro, JA; Mak, ML; Perczel, A; Farkas, O; Enriz, RD
      An exploratory ab initio study of the full conformational space of N-acetyl-L-cysteine-N-methylamide

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM


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Documento generato il 14/08/20 alle ore 08:44:17