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Conformational energy range of ligands in protein crystal structures: the difficult quest for accurate understanding

In this review we address a fundamental question: what is the range of conformational energies seen in ligands in protein-ligand crystal structures? This value is important biophysically, for better understanding the protein-ligand binding process; and practically, for providing a parameter to be us...

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Vydáno v:J Mol Recognit
Hlavní autoři: Peach, Megan L., Cachau, Raul E., Nicklaus, Marc C.
Médium: Artigo
Jazyk:Inglês
Vydáno: 2017
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC5553890/
https://ncbi.nlm.nih.gov/pubmed/28233410
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jmr.2618
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