Ab‐initio molecular dynamics and hybrid...

Journal of Computational Chemistry 2020 / 08

Ab‐initio molecular dynamics and hybrid explicit‐implicit solvation model for aqueous and nonaqueous solvents: GFP chromophore in water and methanol solution as case study

Raucci, Umberto, Perrella, Fulvio, Donati, Greta, Zoppi, Maria, Petrone, Alessio, Rega, Nadia
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Journal:
Journal of Computational Chemistry
DOI:
10.1002/jcc.26384
Date:
August, 2020
File:
PDF, 2.88 MB
2020
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