Works matching IS 01928651 AND DT 2013 AND VI 34 AND IP 3
Results: 12
Rotamer decomposition and protein dynamics: Efficiently analyzing dihedral populations from molecular dynamics.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 198, doi. 10.1002/jcc.23119
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Accurate integration over atomic regions bounded by zero-flux surfaces.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 206, doi. 10.1002/jcc.23121
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Gas-phase reactions of SiH <sub>n</sub><sup>+</sup> (n = 1,2) with NF<sub>3</sub>: A computational investigation on the detailed mechanistic aspects [J. Comp. Chem. 33, 1918-1926].
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 257, doi. 10.1002/jcc.23120
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Inside Cover, Volume 34, Issue 3.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. iii, doi. 10.1002/jcc.23227
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Partial atomic charges and their impact on the free energy of solvation.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 187, doi. 10.1002/jcc.23117
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Exploring the energy landscapes of flexible molecular loops using higher-dimensional continuation.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 234, doi. 10.1002/jcc.23128
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Lattice microbes: High-performance stochastic simulation method for the reaction-diffusion master equation.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 245, doi. 10.1002/jcc.23130
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Cover Image, Volume 34, Issue 3.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. i, doi. 10.1002/jcc.23226
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- Article
The statistical significance of selected sense-antisense peptide interactions [J. Comp. Chem. 33, 1440-1447].
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 256, doi. 10.1002/jcc.23116
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Binding structures of tri- N-acetyl-β-glucosamine in hen egg white lysozyme using molecular dynamics with a polarizable force field.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 163, doi. 10.1002/jcc.23109
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Global and local indices for characterizing biomolecular flexibility and rigidity.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 220, doi. 10.1002/jcc.23122
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BaTiO<sub>3</sub>-based nanolayers and nanotubes: First-principles calculations.
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- Journal of Computational Chemistry, 2013, v. 34, n. 3, p. 175, doi. 10.1002/jcc.23115
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