Publications by authors named "Georgios Iakovou"

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Protein domain movement involved in binding of belinostat and HPOB as inhibitors of histone deacetylase 6 (HDAC6): a hybrid automated-interactive docking study.
Georgios Iakovou, L Palmer, A Ganesan, Akio Kitao, Stephen D Laycock

J Comput Aided Mol Des· July 2025

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Kraft lignin fast (catalytic) pyrolysis for the production of high value-added chemicals (HVACs): A techno-economic screening of valorization pathways.
Georgios Iakovou, Dimitris Ipsakis, Konstantinos S Triantafyllidis

Environ Res· May 2024

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Interactive Flexible-Receptor Molecular Docking in Virtual Reality Using DockIT.
Georgios Iakovou, Stephen D Laycock, Steven Hayward

J Chem Inf Model· December 2022

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DockIT: a tool for interactive molecular docking and molecular complex construction.
Georgios Iakovou, Mousa Alhazzazi, Steven Hayward, Stephen D Laycock

Bioinformatics· April 2021

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Virtual Environment for Studying the Docking Interactions of Rigid Biomolecules with Haptics.
Georgios Iakovou, Steven Hayward, Stephen D Laycock

J Chem Inf Model· May 2017

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Determination of locked interfaces in biomolecular complexes using Haptimol_RD.
Georgios Iakovou, Stephen Laycock, Steven Hayward

Biophys Physicobiol· July 2016

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Adaptive GPU-accelerated force calculation for interactive rigid molecular docking using haptics.
Georgios Iakovou, Steven Hayward, Stephen D Laycock

J Mol Graph Model· September 2015

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A real-time proximity querying algorithm for haptic-based molecular docking.
Georgios Iakovou, Steven Hayward, Stephen Laycock

Faraday Discuss· June 2015

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