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6574 results: 6534 articles and 40 books or book chapters

1. 881 Molecular dynamics simulations of the calmodulin-induced α-helix in the SK2 calcium-gated potassium ion channel
   R. Ramis, O. R. Ballesteros, A. Muguruza-Montero, S. M-Alicante, E. Nunez, A. Villarroel, A. Leonardo, and A. Bergara
   J. Biol. Chem. 299, 102850 (2023).
2. 882 Therapeutic effect of α7 nicotinic receptor activation after ischemic stroke in rats
   L. Aguado, A. Joya, M. Garbizu, S. Plaza-Garcia, L. Iglesias, M. I. Hernandez, M. Ardaya, N. Mocha, V. Gomez-Vallejo, U. Cossio, M. Higuchi, A. Rodriguez-Antiguedad, M. M. Freijo, M. Domercq, C. Matute, P. Ramos-Cabrer, J. Llop, and A. Martin
   J. Cereb. Blood Flow Metab. 43, 1301 (2023).
3. 883 Multimerizations, aggregation, and transfer reactions of small numbers of molecules
   R. Zangi
   J. Chem Inf. Model. 63, 4383 (2023).
4. 884 Molecular Berry curvatures and the adiabatic response tensors
   R. Resta
   J. Chem. Phys. 158, 024105 (2023).
5. 885 Non-simple flow behavior in a polar van der Waals liquid: Structural relaxation under scrutiny
   S. Arrese-Igor, A. Alegria, and J. Colmenero
   J. Chem. Phys. 158, 174504 (2023).
6. 886 The Debye's model for the dielectric relaxation of liquid water and the role of cross-dipolar correlations. A MD-simulations study
   F. Alvarez, A. Arbe, and J. Colmenero
   J. Chem. Phys. 159, 134505 (2023).
7. 887 Outstanding improvement in removing the delocalization error by global natural orbital functional
   J. F. H. Lew-Yee, M. Piris, and J. M. del Campo
   J. Chem. Phys. 158, 084110 (2023).
8. 888 Physical aging in molecular glasses beyond the α relaxation
   V. Di Lisio, V. -M. Stavropoulou, and D. Cangialosi
   J. Chem. Phys. 159, 064505 (2023).
9. 889 Orbital-free density-functional theory for metal slabs
   C. M. Horowitz, C. R. Proetto, and J. M. Pitarke
   J. Chem. Phys. 159, 164112 (2023).
10. 890 What can lattice DFT teach us about real-space DFT?
    N. Sobrino, D. Jacob, and S. Kurth
    J. Chem. Phys. 159, 154110 (2023).
11. 891 Collective dynamics and self-motions in the van der Waals liquid tetrahydrofuran from meso- to inter-molecular scales disentangled by neutron spectroscopy with polarization analysis
    A. Arbe, G. J. Nilsen, M. Devonport, B. Farago, F. Alvarez, J. A. M. Gonzalez, and J. Colmenero
    J. Chem. Phys. 158, 184502 (2023).
12. 892 Electron correlation in the Iron(II) porphyrin by natural orbital functional approximations
    J. F. H. Lew-Yee, J. M. del Campo, and M. Piris
    J. Chem. Theory Comput. 19, 211 (2023).
13. 893 All-purpose measure of electron correlation for multireference diagnostics
    X. Xu, L. Soriano-Agueda, X. Lopez, E. Ramos-Cordoba, and E. Matito
    J. Chem. Theory Comput. 20, 721 (2023).
14. 894 Are accelerated and enhanced wave function methods accurate to compute static linear and nonlinear optical properties?
    C. Naim, P. Besalu-Sala, R. Zalesny, J. M. Luis, F. Castet, and E. Matito
    J. Chem. Theory Comput. 19, 1753 (2023).
15. 895 Extracting quantitative information at quantum mechanical level from noncovalent interaction index analyses
    E. K. Wieduwil, R. A. Boto, G. Macetti, R. Laplaza, J. Contreras-Garcia, and A. Genoni
    J. Chem. Theory Comput. 19, 1063 (2023).
16. 896 Electronic descriptors for supervised spectroscopic predictions
    C. M. de Armas-Morejon, L. A. Montero-Cabrera, A. Rubio, and J. Jornet-Somoza
    J. Chem. Theory Comput. 19, 1818 (2023).
17. 897 Insights into the coordination chemistry of antineoplastic doxorubicinwith 3d-transition metal ions Zn2+, Cu2+, and VO2+: a study using well-calibrated thermodynamic cyclesand chemical interaction quantum chemistry models
    J. Reyna-Luna, L. Soriano-Agueda, C. J. Vera, and M. Franco-Perez
    J. Comput.-Aided Mol. Des. 37, 279 (2023).
18. 898 Euclid: modelling massive neutrinos in cosmology a codecomparison
    J. Adamek, R. E. Angulo, C. Arnold, M. Baldi, M. Biagetti, B. Bose, C. Carbone, T. Castro, J. Dakin, K. Dolag, W. Elbers, C. Fidler, C. Giocoli, S. Hannestad, F. Hassani, C. Hernandez-Aguayo, K. Koyama, B. Li, R. Mauland, P. Monaco, et al.
    J. Cosmol. Astropart. Phys. 06, 035 (2023).
19. 899 Dark matter from primordial black holes would hold charge
    I. J. Araya, N. D. Padilla, M. E. Rubio, J. Sureda, J. Magana, and L. Osorio
    J. Cosmol. Astropart. Phys. 02, 030 (2023).
20. 900 A numerical study of geopolymer concrete thermal energy storage: Benchmarking TES module design and optimizing thermal performance
    M. Rahjoo, E. Rojas, G. Goracci, J. J. Gaitero, P. Martauz, and J. S. Dolado
    J. Energy Storage 74, 109389 (2023).