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Trinity College Dublin

Publications 

TCHPC provides Irish academics with resources and expertise to enable their research in computational science and engineering. The Centre also manages or participated in managing large scale infrastructure and research programs. One of the main outputs from these services is the publications produced by the research groups and the accreditation we receive in these publications. The table below gives a list of the (>260) research publications enabled by TCHPC and our related research and infrastructure programs since 2005.

Title Authors year
A molecular dynamics simulation of the structure and properties of a self assembled monolayer formed from an amphiphilic polymer on a water surface Darren Leith and D. A. Morton-Blake 2005
Understanding the molecular mechanism of estrogen receptor modulators David G. Lloyd, Mary J. Meegan 2005
Synthesis, Structure-Activity Relationships and Antagonistic Effects in Human MCF-7 Breast Cancer Cells of Flexible Estrogen Receptor Modulators David G. Lloyd, Helena M. Smith, Timothy O’Sullivan, Daniela M. Zisterer and Mary J. Meegan 2005
Closest Feature Maps For Time-Critical Collision Handling Giang, T., and O'Sullivan, C. 2005
A framework for comparing task performance in real and virtual scenes Howlett, S., Lee, R., and O'Sullivan, C. 2005
Practical all-to-all propagators for lattice QCD J. Foley et al. 2005
Practical all-to-all propagators for lattice QCD J. Foley, K.J. Juge, A. O Cais, M. Peardon, S.M. Ryan, J-I. Skullerud 2005
The migration of ions through poly(3-octylthiophene) J.Corish and D. A. Morton-Blake 2005
The transport and migration of anions through poly(3-octylthiophene) matrices J.Corish and D.A.Morton-Blake 2005
A Voxel-based Approach to Approximate Collision Handling John Dingliana and Carol O’Sullivan 2005
Perceptual Evaluation of Impostor Representations for Virtual Humans and Buildings John Hamill, Rachel McDonnell, Simon Dobbyn and Carol O'Sullivan 2005
A Virtual Reality Toolkit for the Diagnosis and Monitoring of Myocardial Infarctions John Ryan, Carol O'Sullivan, Christopher Bell and Niall Mulvihill 2005
Comparative Molecular Dynamics Simulations of uncomplexed, ‘agonist-bound’ and ‘antagonist-bound’ α1A Adrenoceptor Models Kinsella, G.K., Rozas, I., Watson, G.W 2005
Molecular mechanism of interaction of catecholamines with the α1A adrenoceptor – towards a ligand induced receptor conformation Kinsella, G.K., Rozas, I., Watson, G.W 2005
LOD Human Representations: A Comparative Study McDonnell, R., Dobbyn, S., and O'Sullivan, C. 2005
An Interruptible Algorithm for Time-Critical Collision Handling Mendoza, C. and O'Sullivan, C 2005
Towards Time-Critical Collision Detection for Deformable Objects Based on Reduced Models Mendoza, C. and O'Sullivan, C. 2005
The electronic structure of HgO and Tl2O3: An experimental and theoretical study P. Glans, T. Learmonth, C. McGuiness, K. Smith, J. Guo, A. Walsh, G. Watson and R. Egdell 2005
Predicting and Evaluating Saliency for Simplified Polygonal Models Sarah Howlett, John Hamill and Carol O'Sullivan 2005
Geopostors: A Real-Time Geometry/Impostor Crowd Rendering System Simon Dobbyn, John Hamill, Keith O'Conor, Carol O'Sullivan 2005
Geopostors: A Real-Time Geometry/Impostor Crowd Rendering System Simon Dobbyn, John Hamill, Keith O'Conor, Carol O'Sullivan 2005
The origin of the Pb(II) stereochemically active lone pair: DFT calculations on PbO and PbS Walsh A. and Watson G.W. 2005
Influence of the Anion on Lone Pair Formation in Sn(II) Monochalcogenides: A DFT Study Walsh and G.W. Watson 2005
A force-field description of short-range repulsions for high density alkane molecular dynamics simulations Joseph M. Hayes, James C. Greer, David A. Morton-Blake 2004
Electronic structures of rock salt, litharge and herzenbergite SnO by density functional theory Walsh A. and Watson G.W. 2004

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