Fully automatic assignment of small molecules' NMR spectra without relying on chemical shift predictions.
- Published in:
- Magnetic Resonance in Chemistry, 2015, v. 53, n. 8, p. 603, doi. 10.1002/mrc.4272
- By:
- Publication type:
- Article
Works matching DE "SPECTROSCOPIC shielding"
Results: 12
1
2
Towards the versatile DFT and MP2 computational schemes for <sup>31</sup>P NMR chemical shifts taking into account relativistic corrections.
- Published in:
- Magnetic Resonance in Chemistry, 2014, v. 52, n. 11, p. 699, doi. 10.1002/mrc.4122
- By:
- Publication type:
- Article
3
Selection functions of large spectroscopic surveys.
- Published in:
- Astronomy & Astrophysics / Astronomie et Astrophysique, 2019, v. 621, p. N.PAG, doi. 10.1051/0004-6361/201834256
- By:
- Publication type:
- Article
4
A Comparative Study of Potential Energy Curves Analytical Representations for CO, N<sub>2</sub>, P<sub>2</sub>, and ScF in Their Ground Electronic States.
- Published in:
- Iraqi Journal of Science, 2021, v. 62, n. 8, p. 2536, doi. 10.24996/ijs.2021.62.8.6
- By:
- Publication type:
- Article
5
A novel γ-lactone derivative from the twigs of Turraea pubescens.
- Published in:
- Zeitschrift für Naturforschung B: A Journal of Chemical Sciences, 2015, v. 70, n. 8, p. 533, doi. 10.1515/znb-2014-0265
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- Publication type:
- Article
6
Preparation and application of ultrahigh-pressure-homogenised aminosilicon-based softeners.
- Published in:
- Coloration Technology, 2014, v. 130, n. 3, p. 174, doi. 10.1111/cote.12078
- By:
- Publication type:
- Article
7
Analysis of buried interfaces in multilayer device structures with hard XPS (HAXPES) using a CrKα source.
- Published in:
- Surface & Interface Analysis: SIA, 2018, v. 50, n. 11, p. 1158, doi. 10.1002/sia.6451
- By:
- Publication type:
- Article
8
Orbital Analysis of Carbon-13 Chemical Shift Tensors Reveals Patterns to Distinguish Fischer and Schrock Carbenes.
- Published in:
- Angewandte Chemie, 2017, v. 129, n. 34, p. 10261, doi. 10.1002/ange.201701537
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- Publication type:
- Article
9
The Status of Slater's Theory of Many-Electron Atoms.
- Published in:
- Comments on Inorganic Chemistry, 2014, v. 34, n. 5-6, p. 178, doi. 10.1080/02603594.2014.896347
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- Publication type:
- Article
10
Orbital solution leading to an acceptable interpretation for the enigmatic gamma-ray binary HESS J0632+057.
- Published in:
- Publications of the Astronomical Society of Japan, 2018, v. 70, n. 4, p. N.PAG, doi. 10.1093/pasj/psy053
- By:
- Publication type:
- Article
11
Three Novel Triterpenoids from Taraxacum officinale Roots.
- Published in:
- Molecules, 2016, v. 21, n. 9, p. 1121, doi. 10.3390/molecules21091121
- By:
- Publication type:
- Article
12
New 3-substituted-2,1-benzisoxazoles: Synthesis and antimicrobial activities.
- Published in:
- Arabian Journal of Chemistry, 2017, v. 10, p. S2464, doi. 10.1016/j.arabjc.2013.09.011
- By:
- Publication type:
- Article