scholarly journals Hybrid MM/CG Webserver: Automatic Set Up of Molecular Mechanics/Coarse-Grained Simulations for Human G Protein-Coupled Receptor/Ligand Complexes

2020 ◽  
Vol 7 ◽  
Author(s):  
Jakob Schneider ◽  
Rui Ribeiro ◽  
Mercedes Alfonso-Prieto ◽  
Paolo Carloni ◽  
Alejandro Giorgetti
Keyword(s):  
Molecular Mechanics ◽  
G Protein ◽  
Coarse Grained ◽  
G Protein Coupled Receptor ◽  
Receptor Ligand ◽  
Coarse Grained Simulations ◽  
Set Up ◽  
G Protein Coupled

scholarly journals Hybrid Molecular Mechanics/Coarse-Grained Simulations for Structural Prediction of G-Protein Coupled Receptor/Ligand Complexes

PLoS ONE ◽  
2012 ◽  
Vol 7 (10) ◽  
pp. e47332 ◽  
Author(s):  
Michael Leguèbe ◽  
Chuong Nguyen ◽  
Luciana Capece ◽  
Zung Hoang ◽  
Alejandro Giorgetti ◽  
...  
Keyword(s):  
Molecular Mechanics ◽  
G Protein ◽  
Coarse Grained ◽  
G Protein Coupled Receptor ◽  
Receptor Ligand ◽  
Structural Prediction ◽  
Coarse Grained Simulations ◽  
G Protein Coupled

scholarly journals Structure-Based Prediction of G-Protein-Coupled Receptor Ligand Function: A β-Adrenoceptor Case Study

2015 ◽  
Vol 55 (5) ◽  
pp. 1045-1061 ◽  
Author(s):  
Albert J. Kooistra ◽  
Rob Leurs ◽  
Iwan J. P. de Esch ◽  
Chris de Graaf
Keyword(s):  
G Protein ◽  
G Protein Coupled Receptor ◽  
Receptor Ligand ◽  
G Protein Coupled
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