MD Simulation of the Na+−Phenylalanine Complex in Water: Competition between Cation−π Interaction and Aqueous Solvation
Author:
Affiliation:
1. Dipartimento di Chimica Fisica ed Inorganica, Università di Bologna, viale Risorgimento 4, I-40137 Bologna, Italy
2. Dipartimento di Chimica, Università Federico II, Complesso Universitario Monte S. Angelo, via Cintia, I-80126 Napoli, Italy
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp055271g
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1. Acetylcholine Binding by a Synthetic Receptor: Implications for Biological Recognition
2. Cation-π Interactions in Chemistry and Biology: A New View of Benzene, Phe, Tyr, and Trp
3. An Absolute Sodium Cation Affinity Scale: Threshold Collision-Induced Dissociation Experiments and ab Initio Theory
4. Hydration of the alkali ions in the gas phase. Enthalpies and entropies of reactions M+(H2O)n-1 + H2O = M+(H2O)n
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