Issue Information.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.27398
- Publication type:
- Article
Works matching IS 01928651 AND DT 2025 AND VI 46 AND IP 4
Results: 7
1
2
Rational Design for Antioxidant Diphenylamine Derivatives Using Quantitative Structure–Activity Relationships and Quantum Mechanics Calculations.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.70055
- By:
- Publication type:
- Article
3
Large‐Scale FMO‐MP2 Calculations of the Spike Protein Droplet Model.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.70052
- By:
- Publication type:
- Article
4
Molecular and Electronic Structure and Properties of the Single Benzene‐Based Fluorophores Containing Guanidine Subunit.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.70054
- By:
- Publication type:
- Article
5
AIMD‐Based Protocols for Modeling Exciplex Fluorescence Spectra and Inter‐System Crossing in Photocatalytic Chromophores.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.70049
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- Publication type:
- Article
6
The Structural, Electronic and Vibrational Properties of LaCrO3. A Quantum Mechanical Investigation by Using an All Electron Gaussian Type Basis Set and a Full Range Hybrid Functional.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.27523
- By:
- Publication type:
- Article
7
Probability Density Analysis Reveals Substantial Differences Between the Dinitrogen and Acetylene Triple Bonds.
- Published in:
- Journal of Computational Chemistry, 2025, v. 46, n. 4, p. 1, doi. 10.1002/jcc.70037
- By:
- Publication type:
- Article