Blueshift of the CN stretching vibration of acetonitrile in solution: computational and experimental study.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2352, doi. 10.1002/jcc.27452
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 2024 AND VI 45 AND IP 28
Results: 7
1
2
Monovalent cation binding to model systems and the macrocyclic depsipeptide, emodepside.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2409, doi. 10.1002/jcc.27451
- By:
- Publication type:
- Article
3
Fast vibrational analysis of molecular systems.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2374, doi. 10.1002/jcc.27450
- By:
- Publication type:
- Article
4
Accelerating wavepacket propagation with machine learning.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2360, doi. 10.1002/jcc.27443
- By:
- Publication type:
- Article
5
Exploring the influence of metal cations on individual hydrogen bonds in Watson–Crick guanine–cytosine DNA base pair: An interacting quantum atoms analysis.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2397, doi. 10.1002/jcc.27441
- By:
- Publication type:
- Article
6
Predicting redox potentials by graph‐based machine learning methods.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2383, doi. 10.1002/jcc.27380
- By:
- Publication type:
- Article
7
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 28, p. 2347, doi. 10.1002/jcc.27161
- Publication type:
- Article