Abigail L. Emtage

The fitness burden imposed by synthesising quorum sensing signals

Avika Ruparell, Jean‐Frédéric Dubern, Catharine A. Ortori et al. · Scientific Reports · 2016 · 47 citations · Full text

Life Sciences, Biology, Microbiology +17

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 Computer-Aided Molecular Design · 2019 · 33 citations

Life Sciences, Bioinformatics, Chemistry +14

Assessing GPCR homology models constructed from templates of various transmembrane sequence identities: Binding mode prediction and docking enrichment

Jason Siau Ee Loo, Abigail L. Emtage, Kar Weng Ng et al. · Journal of Molecular Graphics and Modelling · 2017 · 22 citations

Life Sciences, Bioinformatics, Molecular Biology +17

Ligand discrimination during virtual screening of the CB1 cannabinoid receptor crystal structures following cross-docking and microsecond molecular dynamics simulations

Jason Siau Ee Loo, Abigail L. Emtage, Lahari Murali et al. · RSC Advances · 2019 · 15 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Benchmarking the performance of MM/PBSA in virtual screening enrichment using the GPCR-Bench dataset

Mei Qian Yau, Abigail L. Emtage, Jason Siau Ee Loo · Journal of Computer-Aided Molecular Design · 2020 · 14 citations

Pharmacy, Bioinformatics, Medicinal Chemistry +14