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How Ligand Protonation State Controls Water in Protein-Ligand Binding
The role of water in protein-ligand binding has been an intensely studied topic in recent years; however, how ligand protonation state change perturbs water has not been considered. Here we show that water dynamics and interactions can be controlled by the protonation state of ligand using continuou...
Αποθηκεύτηκε σε:
| Τόπος έκδοσης: | J Phys Chem Lett |
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| Κύριοι συγγραφείς: | , , , |
| Μορφή: | Artigo |
| Γλώσσα: | Inglês |
| Έκδοση: |
2018
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| Θέματα: | |
| Διαθέσιμο Online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6467052/ https://ncbi.nlm.nih.gov/pubmed/30188715 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpclett.8b02440 |
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