REST2 MD clusters data to accompany "Ligand based conformational space studies of the mu-opioid receptor"

System coordinates (gro files) and clustered trajectory frames (xtc files) from REST2 (replica exchange with solute tempering) molecular dynamics simulations of the mu-opioid receptor (MOR) embedded in a POPC membrane, surrounded by water and ions, in complex with the ligands BU72 (B72), morphine (M...

Ausführliche Beschreibung

Bibliographische Detailangaben

1. Verfasser:	M. Sena Jr, Diniz
Format:	Dataset
Sprache:	eng
Schlagworte:	Cluster Analysis G Protein-Coupled Receptor Molecular Dynamics Opioid Receptor
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