Works matching IS 16102940 AND DT 2017 AND VI 23 AND IP 4

Results: 51
    1
    2
    3
    4
    5
    6
    7
    8
    9
    10
    11
    12
    13
    14
    15
    16
    17
    18
    19
    20
    21
    22
    23
    24

    Mutations in catalase-peroxidase KatG from isoniazid resistant Mycobacterium tuberculosis clinical isolates: insights from molecular dynamics simulations.

    Published in:
    Journal of Molecular Modeling, 2017, v. 23, n. 4, p. 1, doi. 10.1007/s00894-017-3290-3
    By:
    • Pimentel, Arethusa Lobo;
    • de Lima Scodro, Regiane Bertin;
    • Caleffi-Ferracioli, Katiany Rizzieri;
    • Siqueira, Vera Lúcia Dias;
    • Campanerut-Sá, Paula Aline Zanetti;
    • Lopes, Luciana Dias Ghiraldi;
    • de Almeida, Aryadne Larissa;
    • Cardoso, Rosilene Fressatti;
    • Seixas, Flavio Augusto Vicente
    Publication type:
    Article
    25

    Quantum isotope effects on the H+Li<sub>2</sub> reaction.

    Published in:
    Journal of Molecular Modeling, 2017, v. 23, n. 4, p. 1, doi. 10.1007/s00894-017-3289-9
    By:
    • da Cunha, Thiago Ferreira;
    • Rivera Vila, Henrique Vieira;
    • Ferreira da Cunha, Wiliam;
    • de Macedo, Luiz Guilherme M.;
    • Gargano, Ricardo
    Publication type:
    Article
    26
    27
    28
    29
    30
    31
    32
    33
    34
    35
    36
    37
    38
    39
    40
    41

    The interaction strengths and spectroscopy parameters of the C<sub>2</sub>H<sub>2</sub>∙∙∙HX and HCN∙∙∙HX complexes (X = F, Cl, CN, and CCH) and related ternary systems valued by fluxes of charge densities: QTAIM, CCFO, and NBO calculations.

    Published in:
    Journal of Molecular Modeling, 2017, v. 23, n. 4, p. 1, doi. 10.1007/s00894-017-3270-7
    By:
    • Viana, Marco A. A.;
    • Araújo, Regiane C. M. U.;
    • Neto, José A. Maia;
    • Chame, Henrique C.;
    • Pereira, Arquimedes M.;
    • Oliveira, Boaz G.
    Publication type:
    Article
    42
    43
    44
    45
    46
    47
    48
    49
    50