Works matching IS 01928651 AND DT 2016 AND VI 37 AND IP 28
Results: 8
A stress tensor and QTAIM perspective on the substituent effects of biphenyl subjected to torsion.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2508, doi. 10.1002/jcc.24476
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- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2479, doi. 10.1002/jcc.24109
- Publication type:
- Article
Exponential repulsion improves structural predictability of molecular docking.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2485, doi. 10.1002/jcc.24473
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- Article
Electrostatic component of binding energy: Interpreting predictions from poisson-boltzmann equation and modeling protocols.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2495, doi. 10.1002/jcc.24475
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- Article
Density functional theory for molecular and periodic systems using density fitting and continuous fast multipole method: Analytical gradients.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2518, doi. 10.1002/jcc.24477
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- Article
Structure and properties of iron oxide clusters: From Fe<sub>6</sub> to Fe<sub>6</sub>O<sub>20</sub> and from Fe<sub>7</sub> to Fe<sub>7</sub>O<sub>24</sub>.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2527, doi. 10.1002/jcc.24478
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- Article
Horizontal vectorization of electron repulsion integrals.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. 2537, doi. 10.1002/jcc.24483
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- Publication type:
- Article
Cover Image, Volume 37, Issue 28.
- Published in:
- Journal of Computational Chemistry, 2016, v. 37, n. 28, p. i, doi. 10.1002/jcc.24492
- Publication type:
- Article