Works matching IS 01928651 AND DT 2021 AND VI 42 AND IP 4
Results: 7
Comment on "Martini force field for protonated polyethyleneimine".
- Published in:
- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 261, doi. 10.1002/jcc.26453
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- Publication type:
- Article
Prediction of lattice energy of benzene crystals: A robust theoretical approach.
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- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 248, doi. 10.1002/jcc.26452
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- Article
Argentophillic interactions in argentum chalcogenides: First principles calculations and topological analysis of electron density.
- Published in:
- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 242, doi. 10.1002/jcc.26451
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- Article
New parallel computing algorithm of molecular dynamics for extremely huge scale biological systems.
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- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 231, doi. 10.1002/jcc.26450
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- Article
Thermochemical stabilities of giant fullerenes using density functional tight binding theory and isodesmic‐type reactions.
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- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 222, doi. 10.1002/jcc.26449
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- Article
Instanton calculations of tunneling splittings in chiral molecules.
- Published in:
- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 210, doi. 10.1002/jcc.26447
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- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2021, v. 42, n. 4, p. 205, doi. 10.1002/jcc.26238
- Publication type:
- Article