Dr Brendan Howlin


Senior Lecturer in Computational Chemistry
PhD CCHEM FRSC
+44 (0)1483 686248
23 AZ 02
9 to 5:30

Academic and research departments

Department of Chemistry.

Biography

Areas of specialism

Molecular Modelling

University roles and responsibilities

  • Chemistry Athena Swan Lead
  • Member of IT Governance Committee
  • Member of FEPS Equality and Diversity Committee

My qualifications

1980
BSc Biological Chemistry
University of Essex
1984
PhD Chemistry
University of Essex

Research

Research interests

Research projects

Research collaborations

Supervision

Postgraduate research supervision

Completed postgraduate research projects I have supervised

My publications

Publications

Dr Brendan Howlin - Selected Recent Publications

Tanczos AC; Palmer RA; Potter BS; Saldanha JW; Howlin BJ. Antagonist binding in the rat muscarinic receptor - A study by docking and X-ray crystallography COMPUTATIONAL BIOLOGY AND CHEMISTRY 2004, Vol 28, Iss 5-6, pp 375-385.

Allington RD; Attwood D; Hamerton I; Hay JN; Howlin BJ. Developing improved models of oxidatively treated carbon fibre surfaces, using molecular simulation COMPOSITES PART A-APPLIED SCIENCE AND MANUFACTURING 2004, Vol 35, Iss 10, pp 1161-1173.

Sfyrakis K; Provata A; Povey DC; Howlin BJ. Local sequential minimization of double stranded B-DNA using Monte Carlo annealing JOURNAL OF MOLECULAR MODELING 2004, Vol 10, Iss 3, pp 185-197.

Hamerton I; Emsley AM; Howlin BJ; Klewpatinond P; Takeda S. Studies on a dicyanate containing four phenylene rings and polycyanurate copolymers. 3. Application of mathematical models to determine the kinetics of the thermal degradation processes POLYMER 2004, Vol 45, Iss 7, pp 2193-2199.

Sfyrakis K; Provata A; Povey DC; Howlin BJ. Full-strand minimization of single and double stranded B-DNA using Monte-Carlo annealing MOLECULAR SIMULATION 2003, Vol 29, Iss 9, pp 555-575.

Hamerton I; Emsley AM; Howlin BJ; Klewpatinond P; Takeda S. Studies on a dicyanate containing four phenylene rings and polycyanurate blends. 2. Application of mathematical models to the catalysed polymerization process POLYMER 2003, Vol 44, Iss 17, pp 4839-4852.

Hamerton I; Hay JN; Howgate G; Howlin BJ; O'Gara P. A novel phenylethynyl-terminated siloxane: Synthesis and electron beam cure HIGH PERFORMANCE POLYMERS 2003, Vol 15, Iss 1, pp 143-154.

van Uden NWA; Hubel H; Faux DA; Tanczos AC; Howlin B; Dunstan DJ.Solvation pressure as real pressure: I. Ethanol and starch under negative pressure JOURNAL OF PHYSICS-CONDENSED MATTER 2003, Vol 15, Iss 10, pp 1577-1584.

Allington RD; Attwood D; Hamerton I; Hay JN; Howlin BJ New force-field parameters for molecular simulations of s-triazine and cyanurate-containing systems. 2 - Application and comparison with different simulation methods POLYMER 2003, Vol 44, Iss 3, pp 793-799.

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