Found: 22
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Improving the flexible molecular fitting technique using distance matrices.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 6, p. 739, doi. 10.1002/jcc.540070606
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- Publication type:
- Article
Ab initio calculations of the electronic structure of helical polymers.
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- Journal of Computational Chemistry, 1984, v. 5, n. 6, p. 535, doi. 10.1002/jcc.540050606
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- Publication type:
- Article
An ex vivo assay to measure the intravitreal mobility of nanomedicines for retinal gene therapy.
- Published in:
- Acta Ophthalmologica (1755375X), 2012, v. 90, p. 0, doi. 10.1111/j.1755-3768.2012.4261.x
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- Publication type:
- Article
Ab initio QM calculation of the electric field convergence versus atomic basis sets in periodic models of proton-substituted zeolites.
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- International Journal of Quantum Chemistry, 2007, v. 107, n. 15, p. 3137, doi. 10.1002/qua.21434
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- Publication type:
- Article
Evaluation of electric field within pores of aluminophosphate sieves<FNR></FNR><FN>The contribution is dedicated to Dr. Enrico Clementi who pioneered high-level quantum mechanical calculations on large systems. </FN>.
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- International Journal of Quantum Chemistry, 2005, v. 105, n. 6, p. 839, doi. 10.1002/qua.20803
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- Publication type:
- Article
Improvement of X‐ray diffraction geometries of water physisorbed in zeolites on the basis of periodic Hartree–Fock calculations.
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- International Journal of Quantum Chemistry, 2005, v. 102, n. 5, p. 971, doi. 10.1002/qua.20463
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- Publication type:
- Article
Cumulative Coordinate Technique for Approximation of High Atomic Multipole Moments of Aluminophosphate Sieves on the Basis of Electron Densities Calculated With DFT Methods.
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- International Journal of Quantum Chemistry, 2005, v. 101, n. 6, p. 807, doi. 10.1002/qua.20341
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- Publication type:
- Article
Influence of hydrogen bonding on the properties of water molecules adsorbed in zeolite frameworks.
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- International Journal of Quantum Chemistry, 2003, v. 92, n. 1, p. 71, doi. 10.1002/qua.10496
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- Publication type:
- Article
Cumulative coordinates for approximations of high-order atomic multipole moments in aluminosilicate and aluminophosphate sieves.
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- International Journal of Quantum Chemistry, 2001, v. 83, n. 2, p. 70, doi. 10.1002/qua.1051
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- Publication type:
- Article
Quadrupole coupling constants C<sub>QQ</sub> for <sup>2</sup>H, <sup>27</sup>Al, and <sup>17</sup>O atoms calculated at the periodic Hartree-Fock level for understanding the geometry of H-form aluminosilicates.
- Published in:
- International Journal of Quantum Chemistry, 2001, v. 82, n. 4, p. 182, doi. 10.1002/qua.1038
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- Publication type:
- Article
Approximations of the Mulliken charges for the oxygen and silicon atoms of zeolite frameworks calculated with a periodic Hartree-Fock scheme.
- Published in:
- International Journal of Quantum Chemistry, 1998, v. 70, n. 4/5, p. 993, doi. 10.1002/(SICI)1097-461X(1998)70:4/5<993::AID-QUA45>3.0.CO;2-Y
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- Article
Introduction.
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- International Journal of Quantum Chemistry, 1993, v. 45, n. 6, p. 489, doi. 10.1002/qua.560450602
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- Publication type:
- Article
Clinical impact of the use of additional ultrasonography in diagnostic breast imaging.
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- 2008
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- Publication type:
- journal article
The BRST-invariant vacuum state of the Gribov–Zwanziger theory.
- Published in:
- European Physical Journal C -- Particles & Fields, 2019, v. 79, n. 9, p. N.PAG, doi. 10.1140/epjc/s10052-019-7235-0
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- Publication type:
- Article
Implementing the Gribov-Zwanziger framework in $$\mathcal {N}=1$$ Super-Yang-Mills in the Landau gauge.
- Published in:
- European Physical Journal C -- Particles & Fields, 2014, v. 74, n. 7, p. 1, doi. 10.1140/epjc/s10052-014-2961-9
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- Publication type:
- Article
Renormalization aspects of $$\mathcal {N}=1$$ Super Yang-Mills theory in the Wess-Zumino gauge.
- Published in:
- European Physical Journal C -- Particles & Fields, 2014, v. 74, n. 4, p. 1, doi. 10.1140/epjc/s10052-014-2844-0
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- Publication type:
- Article
<i>SU</i>(2)×<i>U</i>(1) Yang–Mills theories in 3<i>d</i> with Higgs field and Gribov ambiguity.
- Published in:
- European Physical Journal C -- Particles & Fields, 2013, v. 73, n. 10, p. 1, doi. 10.1140/epjc/s10052-013-2567-7
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- Publication type:
- Article
Ion-exchanged binuclear Ca<sub>2</sub>O<sub>X</sub> clusters, X = 1–4, as active sites of selective oxidation over MOR and FAU zeolites.
- Published in:
- Journal of Computational Chemistry, 2010, v. 31, n. 2, p. 421, doi. 10.1002/jcc.21340
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- Publication type:
- Article
Quick scheme for evaluation of atomic charges in arbitrary aluminophosphate sieves on the basis of electron densities calculated with DFT methods.
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- Journal of Computational Chemistry, 2007, v. 28, n. 10, p. 1695, doi. 10.1002/jcc.20660
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- Publication type:
- Article
Photoionization spectra of B-DNA and Z-DNA.
- Published in:
- International Journal of Quantum Chemistry, 1983, v. 24, p. 11, doi. 10.1002/qua.560240706
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- Publication type:
- Article
Theoretical and computational chemistry of complex systems: Solvation of DNA and proteins.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 21, n. 3, p. 409, doi. 10.1002/qua.560220840
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- Publication type:
- Article
Symmetry dilemmas in oxocarbons.
- Published in:
- International Journal of Quantum Chemistry, 1981, v. 20, p. 219, doi. 10.1002/qua.560200824
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- Publication type:
- Article