Dear Colleagues,
The Italian NMR Discussion Group (GIDRM) is organising the workshop: “Simulation Software in Magnetic Resonance”, to be held online via Zoom on Friday 21st January 2022.
During this workshop, the developers of three major simulations software packages used in magnetic resonance will summarise the structure and functionality of their code. Selected forefront research topics, enabled or supported by such software, will be presented by a panel of experts in magnetic resonance to further highlight the current capabilities of the three discussed software tools.
The event is free but registration is required. Please register at: http://www.gidrm.org/index.php/activities/workshops/2021-workshops/gidrm-day-simulation-software-in-magnetic-resonance
The deadline for registration is 11 January 2022, 5PM CET.
For further information contact: soton2021@gidrm.org
Scientific Programme (CET time zone):
10:15-10:30 Opening Session (GIDRM Board)
10:30-11:15 Malcolm H. Levitt (University of Southampton), SpinDynamica: Symbolic and numerical magnetic resonance in Mathematica
11:15-11:45 Christian Bengs (University of Southampton) “Insights into low-field NMR with SpinDynamica”
11:45-12:30 Thomas Vosegaard (Aarhus University) “SIMPSON: A General Simulation Program for Solid-State NMR Spectroscopy”
Lunch Break
14:30-15:00 Zdněck Tošner (Charles University in Prague) SIMPSON simulations of proton lineshapes in magic angle spinning NMR experiments on proteins: How fast is fast enough?
15:00-15:45 Ilya Kuprov (University of Southampton) Simulating the whole of magnetic resonance: software engineering aspects
15:45-16:15 Haribabu Arthanari (Harvard University) “Exploring the uncharted waters in magnetic resonance where Spinach leads the way”
Looking forward to welcoming you all,
Giuseppe Pileio (chair) on behalf of GIDRM
Dr. Giuseppe Pileio, PhD, FHEA
Lecturer in Physical Chemistry,
Chemistry MSc Director of Programmes,
Department of Chemistry,
Building 27 - Room 2025,
University of Southampton,
University Road, SO17 1BJ,
Internal Post Code: M16,
Southampton, Hampshire, UK.
Tel.: +44 (023) 80 59 4160
E-mail: G.Pileio@soton.ac.uk
ORCID: 0000-0001-9223-3896
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