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Journal Articles
- 2024
[j9]Julia Liang, Eleni Pitsillou, Tom C. Karagiannis:
Investigation of RNA-binding protein NOVA1 in silico: Comparison of the modern human V197 with the archaic I197 variant present in Neanderthals. Comput. Biol. Medicine 183: 109278 (2024)- 2022
- [j8]Eleni Pitsillou, Julia Liang
, Raymond C. Beh, Jacqueline Prestedge, Seda Catak, Andrew Hung, Tom C. Karagiannis:
Identification of novel bioactive compounds from Olea europaea by evaluation of chemical compounds in the OliveNet™ library: in silico bioactivity and molecular modelling, and in vitro validation of hERG activity. Comput. Biol. Medicine 142: 105247 (2022) - [j7]Eleni Pitsillou, Julia Liang, Raymond C. Beh, Andrew Hung, Tom C. Karagiannis:
Molecular dynamics simulations highlight the altered binding landscape at the spike-ACE2 interface between the Delta and Omicron variants compared to the SARS-CoV-2 original strain. Comput. Biol. Medicine 149: 106035 (2022) - 2020
- [j6]Eleni Pitsillou, Julia Liang, Andrew Hung, Tom C. Karagiannis:
Molecular docking utilising the OliveNet™ library reveals novel phenolic compounds which may potentially target key proteins associated with major depressive disorder. Comput. Biol. Chem. 86: 107234 (2020) - [j5]Julia Liang, Eleni Pitsillou, Abella Y. L. Man, Sibonginkosi Madzima, Sarah M. Bresnehan, Michael E. Nakai, Andrew Hung, Tom C. Karagiannis:
Utilisation of the OliveNet™ Library to investigate phenolic compounds using molecular modelling studies in the context of Alzheimer's disease. Comput. Biol. Chem. 87: 107271 (2020) - [j4]Julia Liang, Eleni Pitsillou, Chris Karagiannis, Kevion K. Darmawan, Ken Ng, Andrew Hung, Tom C. Karagiannis:
Interaction of the prototypical α-ketoamide inhibitor with the SARS-CoV-2 main protease active site in silico: Molecular dynamic simulations highlight the stability of the ligand-protein complex. Comput. Biol. Chem. 87: 107292 (2020) - [j3]Julia Liang, Chris Karagiannis, Eleni Pitsillou, Kevion K. Darmawan, Ken Ng, Andrew Hung, Tom C. Karagiannis:
Site mapping and small molecule blind docking reveal a possible target site on the SARS-CoV-2 main protease dimer interface. Comput. Biol. Chem. 89: 107372 (2020) - [j2]Eleni Pitsillou, Julia Liang, Chris Karagiannis, Katherine Ververis, Kevion K. Darmawan, Ken Ng, Andrew Hung, Tom C. Karagiannis:
Interaction of small molecules with the SARS-CoV-2 main protease in silico and in vitro validation of potential lead compounds using an enzyme-linked immunosorbent assay. Comput. Biol. Chem. 89: 107408 (2020) - 2018
- [j1]Natalie P. Bonvino, Julia Liang, Elizabeth D. McCord, Elena Zafiris, Natalia Benetti, Nancy B. Ray, Andrew Hung, Dimitrios Boskou, Tom C. Karagiannis:
OliveNet™: a comprehensive library of compounds from Olea europaea. Database J. Biol. Databases Curation 2018: bay016 (2018)
Coauthor Index
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