Works matching IS 01928651 AND DT 2013 AND VI 34 AND IP 25
Results: 11
Comparison of treecodes for computing electrostatic potentials in charged particle systems with disjoint targets and sources.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2159, doi. 10.1002/jcc.23371
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- Article
Global optimization of parameters in the reactive force field ReaxFF for SiOH.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2178, doi. 10.1002/jcc.23382
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- Article
CHARMM36 all-atom additive protein force field: Validation based on comparison to NMR data.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2135, doi. 10.1002/jcc.23354
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- Article
Cover Image, Volume 34, Issue 25.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. i, doi. 10.1002/jcc.23425
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- Article
GALAMOST: GPU-accelerated large-scale molecular simulation toolkit.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2197, doi. 10.1002/jcc.23365
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Auxiliary basis sets for density-fitting second-order Møller-Plesset perturbation theory: Weighted core-valence correlation consistent basis sets for the 4 d elements Y-Pd.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2168, doi. 10.1002/jcc.23372
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Evaluation of electrostatic descriptors for predicting crystalline density.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2146, doi. 10.1002/jcc.23369
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- Article
GTKDynamo: A PyMOL plug-in for QC/MM hybrid potential simulations.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2190, doi. 10.1002/jcc.23346
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- Article
Transition polarizability model of induced resonance Raman optical activity.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2152, doi. 10.1002/jcc.23370
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- Article
Inside Cover, Volume 34, Issue 25.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. iii, doi. 10.1002/jcc.23426
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- Article
VinaMPI: Facilitating multiple receptor high-throughput virtual docking on high-performance computers.
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- Journal of Computational Chemistry, 2013, v. 34, n. 25, p. 2212, doi. 10.1002/jcc.23367
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- Article