Aoife M Harbison

Affiliations

Department of Chemistry and Hamilton Institute, Maynooth University, Maynooth, Kildare, Ireland.

Publications (7)

SARS-CoV-2 Simulations Go Exascale to Capture Spike Opening and Reveal Cryptic Pockets Across the Proteome.

bioRxiv : the preprint server for biology

Avec: Maxwell I Zimmerman , Justin R Porter , Michael D Ward , Sukrit Singh , Neha Vithani , Artur Meller , Upasana L Mallimadugula , Catherine E Kuhn , Jonathan H Borowsky , Rafal P Wiewiora , Matthew F D Hurley , Aoife M Harbison , Carl A Fogarty , Joseph E Coffland , Elisa Fadda , Vincent A Voelz , John D Chodera , Gregory R Bowman

SARS-CoV-2 simulations go exascale to predict dramatic spike opening and cryptic pockets across the proteome.

Nature chemistry

Avec: Maxwell I Zimmerman , Justin R Porter , Michael D Ward , Sukrit Singh , Neha Vithani , Artur Meller , Upasana L Mallimadugula , Catherine E Kuhn , Jonathan H Borowsky , Rafal P Wiewiora , Matthew F D Hurley , Aoife M Harbison , Carl A Fogarty , Joseph E Coffland , Elisa Fadda , Vincent A Voelz , John D Chodera , Gregory R Bowman

Restoring protein glycosylation with GlycoShape.

Nature methods

Avec: Callum M Ives , Ojas Singh , Silvia D'Andrea , Carl A Fogarty , Aoife M Harbison , Akash Satheesan , Beatrice Tropea , Elisa Fadda

How and why plants and human N-glycans are different: Insight from molecular dynamics into the "glycoblocks" architecture of complex carbohydrates.

Beilstein journal of organic chemistry

Avec: Carl A Fogarty , Aoife M Harbison , Amy R Dugdale , Elisa Fadda

Circulating SARS-CoV-2 spike N439K variants maintain fitness while evading antibody-mediated immunity.

Cell

Avec: Emma C Thomson , Laura E Rosen , James G Shepherd , Roberto Spreafico , Ana da Silva Filipe , Jason A Wojcechowskyj , Chris Davis , Luca Piccoli , David J Pascall , Josh Dillen , Spyros Lytras , Nadine Czudnochowski , Rajiv Shah , Marcel Meury , Natasha Jesudason , Anna De Marco , Kathy Li , Jessica Bassi , Aine O'Toole , Dora Pinto , Rachel M Colquhoun , Katja Culap , Ben Jackson , Fabrizia Zatta , Andrew Rambaut , Stefano Jaconi , Vattipally B Sreenu , Jay Nix , Ivy Zhang , Ruth F Jarrett , William G Glass , Martina Beltramello , Kyriaki Nomikou , Matteo Pizzuto , Lily Tong , Elisabetta Cameroni , Tristan I Croll , Natasha Johnson , Julia Di Iulio , Arthur Wickenhagen , Alessandro Ceschi , Aoife M Harbison , Daniel Mair , Paolo Ferrari , Katherine Smollett , Federica Sallusto , Stephen Carmichael , Christian Garzoni , Jenna Nichols , Massimo Galli , Joseph Hughes , Agostino Riva , Antonia Ho , Marco Schiuma , Malcolm G Semple , Peter J M Openshaw , Elisa Fadda , J Kenneth Baillie , John D Chodera , Auteur inconnu , Auteur inconnu , Suzannah J Rihn , Samantha J Lycett , Herbert W Virgin , Amalio Telenti , Davide Corti , David L Robertson , Gyorgy Snell

Role of N343 glycosylation on the SARS-CoV-2 S RBD structure and co-receptor binding across variants of concern.

eLife

Avec: Callum M Ives , Linh Nguyen , Carl A Fogarty , Aoife M Harbison , Yves Durocher , John Klassen , Elisa Fadda

Ten-year statewide cross-sectional review of pediatric sinogenic intracranial abscess and empyema in Queensland, Australia: microbial profile before and after COVID-19.

Journal of neurosurgery. Pediatrics

Avec: Michael J Stuart , Annabelle M Harbison , Norman Ma , Robert A J Campbell , Amelia J Jardim , David S Anderson , Teresa K Withers , Liam G Coulthard

Réseau de co-auteurs

Elisa Fadda 6 collaborations

Carl A Fogarty 5 collaborations

John D Chodera 3 collaborations

Maxwell I Zimmerman 2 collaborations

Justin R Porter 2 collaborations

Michael D Ward 2 collaborations

Sukrit Singh 2 collaborations

Neha Vithani 2 collaborations

Artur Meller 2 collaborations

Upasana L Mallimadugula 2 collaborations

Catherine E Kuhn 2 collaborations

Jonathan H Borowsky 2 collaborations

Rafal P Wiewiora 2 collaborations

Matthew F D Hurley 2 collaborations

Joseph E Coffland 2 collaborations

Vincent A Voelz 2 collaborations

Gregory R Bowman 2 collaborations

Callum M Ives 2 collaborations

None None 2 collaborations

Ojas Singh 1 collaboration

Silvia D'Andrea 1 collaboration

Akash Satheesan 1 collaboration

Beatrice Tropea 1 collaboration

Amy R Dugdale 1 collaboration

Emma C Thomson 1 collaboration

Laura E Rosen 1 collaboration

James G Shepherd 1 collaboration

Roberto Spreafico 1 collaboration

Ana da Silva Filipe 1 collaboration

Jason A Wojcechowskyj 1 collaboration

Chris Davis 1 collaboration

Luca Piccoli 1 collaboration

David J Pascall 1 collaboration

Josh Dillen 1 collaboration

Spyros Lytras 1 collaboration

Nadine Czudnochowski 1 collaboration

Rajiv Shah 1 collaboration

Marcel Meury 1 collaboration

Natasha Jesudason 1 collaboration

Anna De Marco 1 collaboration

Kathy Li 1 collaboration

Jessica Bassi 1 collaboration

Aine O'Toole 1 collaboration

Dora Pinto 1 collaboration

Rachel M Colquhoun 1 collaboration

Katja Culap 1 collaboration

Ben Jackson 1 collaboration

Fabrizia Zatta 1 collaboration

Andrew Rambaut 1 collaboration

Stefano Jaconi 1 collaboration

Vattipally B Sreenu 1 collaboration

Jay Nix 1 collaboration

Ivy Zhang 1 collaboration

Ruth F Jarrett 1 collaboration

William G Glass 1 collaboration

Martina Beltramello 1 collaboration

Kyriaki Nomikou 1 collaboration

Matteo Pizzuto 1 collaboration

Lily Tong 1 collaboration

Elisabetta Cameroni 1 collaboration

Tristan I Croll 1 collaboration

Natasha Johnson 1 collaboration

Julia Di Iulio 1 collaboration

Arthur Wickenhagen 1 collaboration

Alessandro Ceschi 1 collaboration

Daniel Mair 1 collaboration

Paolo Ferrari 1 collaboration

Katherine Smollett 1 collaboration

Federica Sallusto 1 collaboration

Stephen Carmichael 1 collaboration

Christian Garzoni 1 collaboration

Jenna Nichols 1 collaboration

Massimo Galli 1 collaboration

Joseph Hughes 1 collaboration

Agostino Riva 1 collaboration

Antonia Ho 1 collaboration

Marco Schiuma 1 collaboration

Malcolm G Semple 1 collaboration

Peter J M Openshaw 1 collaboration

J Kenneth Baillie 1 collaboration

Suzannah J Rihn 1 collaboration

Samantha J Lycett 1 collaboration

Herbert W Virgin 1 collaboration

Amalio Telenti 1 collaboration

Davide Corti 1 collaboration

David L Robertson 1 collaboration

Gyorgy Snell 1 collaboration

Linh Nguyen 1 collaboration

Yves Durocher 1 collaboration

John Klassen 1 collaboration

Michael J Stuart 1 collaboration

Annabelle M Harbison 1 collaboration

Norman Ma 1 collaboration

Robert A J Campbell 1 collaboration

Amelia J Jardim 1 collaboration

David S Anderson 1 collaboration

Teresa K Withers 1 collaboration

Liam G Coulthard 1 collaboration