Effects of oxidative adsorbates and cluster formation on the electronic structure of nanodiamonds.
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- Journal of Computational Chemistry, 2022, v. 43, n. 13, p. 923, doi. 10.1002/jcc.26849
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- Publication type:
- Article
Works matching IS 01928651 AND DT 2022 AND VI 43 AND IP 13
Results: 6
1
2
Is conformation relevant for QSAR purposes? 2D Chemical representation in a 3D‐QSAR perspective.
- Published in:
- Journal of Computational Chemistry, 2022, v. 43, n. 13, p. 917, doi. 10.1002/jcc.26848
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- Publication type:
- Article
3
prepareforleap: An automated tool for fast PDB‐to‐parameter generation.
- Published in:
- Journal of Computational Chemistry, 2022, v. 43, n. 13, p. 930, doi. 10.1002/jcc.26847
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- Publication type:
- Article
4
Conformations and binding pockets of HRas and its guanine nucleotide exchange factors complexes in the guanosine triphosphate exchange process.
- Published in:
- Journal of Computational Chemistry, 2022, v. 43, n. 13, p. 906, doi. 10.1002/jcc.26846
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- Publication type:
- Article
5
CSiGaAl<sub>2</sub><sup>−/0</sup> and CGeGaAl<sub>2</sub><sup>−/0</sup> having planar tetracoordinate carbon atoms in their global minimum energy structures.
- Published in:
- Journal of Computational Chemistry, 2022, v. 43, n. 13, p. 894, doi. 10.1002/jcc.26845
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- Publication type:
- Article
6
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2022, v. 43, n. 13, p. 889, doi. 10.1002/jcc.26611
- Publication type:
- Article