Browsing by Author "9c290d51-edf2-48a3-8d82-7bdc28988737"
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Yepes, Diana; Munarriz, Julen; l'Anson, Daniel; Contreras García, Julia; Jaque Olmedo, Pablo (American Chemical Society, 2020)In this article, we present a complementary analysis based on the reaction force F(xi)/reaction force constant kappa(xi) and noncovalent interactions (NCI) index to characterize the energetics (kinetic and thermodynamics) ...