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Journal of Computer-Aided Molecular Design
|
August 28, 2020
Benchmarking the performance of MM/PBSA in virtual screening enrichment using the GPCR-Bench dataset
Mei Qian Yau, Abigail L Emtage, Jason S E Loo
Journal of Biomolecular Structure & Dynamics
|
August 18, 2016
GPCRs through the keyhole: the role of protein flexibility in ligand binding to β-adrenoceptors
Abigail L Emtage, Shailesh N Mistry, Peter M Fischer, et al.
Journal of Computer-Aided Molecular Design
|
April 17, 2019
Evaluating the performance of MM/PBSA for binding affinity prediction using class A GPCR crystal structures
Mei Qian Yau, Abigail L Emtage, Nathaniel J Y Chan, et al.
Journal of Molecular Graphics & Modelling
|
January 8, 2018
Assessing GPCR homology models constructed from templates of various transmembrane sequence identities: Binding mode prediction and docking enrichment
Jason S E Loo, Abigail L Emtage, Kar Weng Ng, et al.
RSC Advances
|
May 6, 2022
Ligand discrimination during virtual screening of the CB1 cannabinoid receptor crystal structures following cross-docking and microsecond molecular dynamics simulations
Jason S E Loo, Abigail L Emtage, Lahari Murali, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
Journal of Computer-Aided Molecular Design
|
August 28, 2020
Benchmarking the performance of MM/PBSA in virtual screening enrichment using the GPCR-Bench dataset
Mei Qian Yau, Abigail L Emtage, Jason S E Loo
Journal of Biomolecular Structure & Dynamics
|
August 18, 2016
GPCRs through the keyhole: the role of protein flexibility in ligand binding to β-adrenoceptors
Abigail L Emtage, Shailesh N Mistry, Peter M Fischer, et al.
Journal of Computer-Aided Molecular Design
|
April 17, 2019
Evaluating the performance of MM/PBSA for binding affinity prediction using class A GPCR crystal structures
Mei Qian Yau, Abigail L Emtage, Nathaniel J Y Chan, et al.
Journal of Molecular Graphics & Modelling
|
January 8, 2018
Assessing GPCR homology models constructed from templates of various transmembrane sequence identities: Binding mode prediction and docking enrichment
Jason S E Loo, Abigail L Emtage, Kar Weng Ng, et al.
RSC Advances
|
May 6, 2022
Ligand discrimination during virtual screening of the CB1 cannabinoid receptor crystal structures following cross-docking and microsecond molecular dynamics simulations
Jason S E Loo, Abigail L Emtage, Lahari Murali, et al.
Page
of 1