Ushbu ish iqtibos qilgan ishlar

67 ta ish

Ish: Unveiling the Borohydride Ion through Force-Field Development

1. <i>Ab</i> <i>initio</i> molecular dynamics simulation of liquid water: Comparison of three gradient-corrected density functionals

   Michiel Sprik, Jürg Hutter, Michele Parrinello

   Maqola19963 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.182875

2. GROMACS 3.0: a package for molecular simulation and trajectory analysis

   Erik Lindahl, Berk Hess, David van der Spoel

   Maqola20013 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.182899

3. Thermodynamics of solvation of ions. Part 5.—Gibbs free energy of hydration at 298.15 K

   Yizhak Marcus

   Maqola19913 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.401283

4. The Statistical Mechanical Theory of Solutions. I

   John G. Kirkwood, Frank P. Buff

   Maqola19512 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.040246

5. Property-optimized Gaussian basis sets for molecular response calculations

   Dmitrij Rappoport, Filipp Furche

   Maqola20102 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.083476

6. Hydrophobicity at Small and Large Length Scales

   Ka Lum, David Chandler, John D. Weeks

   Maqola19992 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.154932

7. A Kirkwood-Buff Derived Force Field for Aqueous Alkali Halides

   Moon Bae Gee, Nicholas R. Cox, Yuanfang Jiao +3

   Maqola20112 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.182881

8. Calculation of Solvation Free Energies of Charged Solutes Using Mixed Cluster/Continuum Models

   Vyacheslav S. Bryantsev, Mamadou S. Diallo, William A. Goddard

   Maqola20082 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.191285

9. Conductor-like Screening Model for Real Solvents: A New Approach to the Quantitative Calculation of Solvation Phenomena

   Andreas Klamt

   Maqola19952 iqtibos

   ABIABI:AkademIndex/openalex/2026.other.401288

10. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401275

11. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401277

12. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401278

13. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401279

14. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401280

15. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401281

16. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401282

17. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401285

18. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401286

19. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401287

20. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401289

21. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401290

22. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401291

23. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401292

24. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401293

25. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/openalex/2026.other.401294