Works matching IS 01928651 AND DT 2023 AND VI 44 AND IP 11
Results: 7
Energy transfer between Si nanocrystals and protoporphyrin molecules as a function of distance, orientation and size.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1138, doi. 10.1002/jcc.27071
- By:
- Publication type:
- Article
Realistic nuclear charge distribution model function for analytic nuclear attraction integrals in Gaussian basis functions.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1148, doi. 10.1002/jcc.27072
- By:
- Publication type:
- Article
Molecular mechanism of binding between a therapeutic RNA aptamer and its protein target VEGF: A molecular dynamics study.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1129, doi. 10.1002/jcc.27070
- By:
- Publication type:
- Article
Correlation consistent auxiliary basis sets in density fitting Hartree–Fock: The atoms sodium through argon revisited.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1119, doi. 10.1002/jcc.27069
- By:
- Publication type:
- Article
Libkrylov: A modular open‐source software library for extremely large on‐the‐fly matrix computations.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1105, doi. 10.1002/jcc.27068
- By:
- Publication type:
- Article
Enhanced conformational exploration of protein loops using a global parameterization of the backbone geometry.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1094, doi. 10.1002/jcc.27067
- By:
- Publication type:
- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2023, v. 44, n. 11, p. 1089, doi. 10.1002/jcc.26905
- Publication type:
- Article