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Contact details

Georgios A. Spyroulias, PhD.
Department of Pharmacy
University of Patras
GR-26504 Patras, GREECE
Tel:    +30.2610.969950 (office)
+30.2610.969951 (terra silico)
+30.2610.969952 (terra vitro)
Fax:    +30.2610.969950
Email:  G.A.Spyroulias@upatras.gr

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Now is: 2017-09-22 17:03
The lab is equipped with 9 powerful computational systems (single, dual-core and double dual-core 2.4 – 3.2 GHz processors) running under Linux and Windows OS. On these systems various specialized software have been installed and are suitable for: (a) Design, molecular building, visualization and analysis such as MolMol, Rasmol, VMD, and others, (b) Biomolecular simulations such as Modeller (Departments of Biopharmaceutical Sciences and Pharmaceutical Chemistry, and California Institute for Quantitative Biomedical Research, University of California, CA, USA) AMBER 9.0 (license is kindly provided by Dr. D.A. Case, BioMaPS Institute and Dept. of Chemistry & Chemical Biology, Rutgers University, NY, USA), AutoDOCK (Department of Molecular Biology, The Scripps Research Institute, La Jolla, USA), (c) design and evolution of virtual chemical libraries (omega, ???) etc. and analysis, (d) processing and analysis of NMR data (assignment of homo/hetero-nuclear multidimensional spectra, like CARA (ETH, Zurich, Switzerland), and (e) conformational analysis and structure calculation of peptides and proteins.