Events Search and Views Navigation
October 2011
Uppsala: The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY
Another meeting in the series The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY will take place tomorrow. Details below. ******************************************************* Time: 15.15 - 16.15 Wednesday 5 October 2011 Room: Ångström 2004 Contents: Two speakers 2 x 20 minutes + discussion 1. Felix Ho, "A combined in silico and in vivo study of a putative proton channel in the water splitting enzyme Photosystem II" 2. Henrik Ottosson: "Aromaticity and antiaromaticity: Fluffy organic chemistry concepts, or something more?" Refreshments will…
Find out more »February 2012
Uppsala: The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY
Another seminar in the series The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY will take place 15 February. Details below. Prelminary times for the other seminars this spring are: Wednesday 21/3, Thursday 19/4, Wednesday 23/5 ******************************************************* Time: 16.15 Wednesday 15 February 2012 Room: Ångström 12167 Contents: Two speakers 2 x (~20 + 5) minutes 1. Marcus Lundberg: "Probing transition-metal bonds using theoretical models of X-ray spectra." 2. Anders Karlén: "Virtual screening in drug discovery." 3. Short discussion about…
Find out more »March 2012
Density Functional based Tight Binding (DFTB) workshop
Density Functional based Tight Binding (DFTB) workshop – Uppsala. Place: Uppsala University Date: Wednesday-Thursday, March 14-15, 2012 organized by Professor Karin Larson, Department of Chemistry - Ångström Laboratory Uppsala University. Prominent guest to the workshop is Professor Thomas Frauenheim, University of Bremen, http://www.bccms.uni-bremen.de Please find short introduction to the subject and abstracts for some of the talks attached in this announcement. ABSintroBCCMS, AbstractUppsala1 , AbstractUppsala2 For further details and registration to the workshop, please contact Prof. K. Larson at e-mail:…
Find out more »Uppsala: The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY
Another meeting in the series The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY will take place today 21 March. Details below. Today's presentations deal with materials - but very different ones - and very different methods are used/developed. ******************************************************* Time: 16.15 Wednesday 21 March 2012 Room: Ångström 2002 Contents: Two speakers 2 x (~15 + 5) minutes + a short e-science discussion 1. Wim Briels: "Newton, Langevin, Brown and Soft Matter - Memory matter(s)" 2. Jolla Kullgren: "Chemically…
Find out more »Uppsala: Inauguration of UPPMAX new compute cluster “Tintin”
Inauguration of UPPMAX new compute cluster “Tintin” Thursday, March 29 15.00-17.00 Häggsalen Ångströmlaboratoriet 15.00 – 15.05 Welcome David van der Spoel, Chairman, UPPMAX 15.05 – 15.20 UPPMAX and the compute cluster “Tintin” Hans Karlsson, Director, UPPMAX 15.20 – 15.45 Inauguration User presentations 15.45 – 16.15 Non-linear and inertia-like effects in magnetic switching processes Anders Bergman, Department of Physics and Astronomy 16.15 – 16.45 DOG: How comparative genetics informs human disease Jennifer Meadows, Department of Medical Biochemistry and Microbiology
Find out more »April 2012
Uppsala:The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY
The third meeting this semester in the series The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY will take place next week, Thursday 26 March. Details below. ******************************************************* Time: 15.15 Thursday 26 April 2012 Room: Ångström 2002 Contents: Two speakers 2 x (~18 + 5) minutes 1. Hans Karlsson: "Dynamics in a photo-excited molecule" 2. Lynn Kamerlin: "Computational protein evolution" 3. Short discussion about news & matters of interest. Come at 15 if you want fika/refreshments before the talks.…
Find out more »May 2012
Uppsala: SNIC Cloud Computing Course at UPPMAX
Course description: This is a beginners course on cloud computing for SNIC users and Uppsala University researchers. This course is part of the SNIC Cloud Project, helping SNIC users start using cloud computing. After the course the researchers will be able to use basic Amazon services. SNIC Cloud project will also offer Amazon resources for longer use for a selected group of users (through UPPMAX).
Find out more »Uppsala:The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY
The fourth meeting of this semester in the series The eSSENCE of . . . COMPUTATIONAL & THEORETICAL CHEMISTRY will take place this week, namely Wednesday 23 May. Details below. ******************************************************* Time: 15.15 Wednesday 23 May 2012 Room: Ångström 2003 Contents: Two speakers 2 x (~18 + 5) minutes 1. Henrik Keränen: "Modelling problems for ion channels" 2. Matti Hellström: "Cu nucleation on ZnO" 3. Short discussion about news & matters of interest (e.g. upcoming conferences) Come at 15 if…
Find out more »Uppsala: NorduGrid 2012 Conference
The NorduGrid 2012conference will take place in Uppsala, Sweden, on May 30 - June 1, 2012. The conference is dedicated to enabling infrastructures for e-Science using ARC. As usual, the conference will include both the plenary sessions and the technical workshop dedicated to ARC development issues. Scientific programme This year the conference is dedicated to issues related to enabling e-Science infrastructures using ARC. Possible topics include: International infrastructures using ARC National infrastructures using ARC Application-specific and collaboration environments enabled by…
Find out more »Uppsala: PSCP Colloquium
The June meeting will be an exception from our general schedule: it will take place on Wednesday, May 30, at 13.15, with guest David Clarke,School of Computer Science and Informatics, University College Dublin, who will present his very interesting work on 'Hierarchical partitioning algorithm for scientific computing on highly heterogeneous CPU+GPU clusters'
Find out more »