[HTML][HTML] Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery

K McKay, NB Hamilton, JM Remington… - Frontiers in Molecular …, 2022 - frontiersin.org
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …

Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery.

K McKay, NB Hamilton, JM Remington… - Frontiers in Molecular …, 2022 - europepmc.org
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …

Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery

K McKay, NB Hamilton, JM Remington… - Frontiers in Molecular …, 2022 - par.nsf.gov
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …

Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery

K McKay, NB Hamilton… - Frontiers in …, 2022 - pubmed.ncbi.nlm.nih.gov
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …

Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery

K McKay, NB Hamilton, JM Remington, ST Schneebeli… - 2022 - agris.fao.org
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …

Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery

K McKay, NB Hamilton, JM Remington… - … and kinetics of …, 2023 - books.google.com
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …

[HTML][HTML] Essential Dynamics Ensemble Docking for Structure-Based GPCR Drug Discovery

K McKay, NB Hamilton, JM Remington… - Frontiers in Molecular …, 2022 - ncbi.nlm.nih.gov
The lack of biologically relevant protein structures can hinder rational design of small
molecules to target G protein-coupled receptors (GPCRs). While ensemble docking using …