Predicting solvation free energies for neutral molecules in any solvent with openCOSMO-RS

Fuente: arXiv

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Bibliographic Details
Main Authors:	Müller, Simon, Nevolianis, Thomas, Garcia-Ratés, Miquel, Riplinger, Christoph, Leonhard, Kai, Smirnova, Irina
Format:	Preprint
Published:	2024
Subjects:	Chemical Physics Soft Condensed Matter Computational Physics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2407.03434