Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 30
Results: 7
Massively parallel algorithm and implementation of RI-MP2 energy calculation for peta-scale many-core supercomputers.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2623, doi. 10.1002/jcc.24491
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- Article
The role of dispersive forces determining the energetics of adsorption in Ti zeolites.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2659, doi. 10.1002/jcc.24509
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- Publication type:
- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2617, doi. 10.1002/jcc.24113
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- Article
Cover Image, Volume 37, Issue 30.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. i, doi. 10.1002/jcc.24514
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- Article
PyMOL360: Multi-user gamepad control of molecular visualization software.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2667, doi. 10.1002/jcc.24489
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- Article
Assessing the attractive/repulsive force balance in axial cyclohexane C-H<sub>ax</sub>···Y<sub>ax</sub> contacts: A combined computational analysis in monosubstituted cyclohexanes.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2647, doi. 10.1002/jcc.24496
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- Article
A kinetic chain growth algorithm in coarse-grained simulations.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2634, doi. 10.1002/jcc.24495
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- Article