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VERSION:2.0
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CALSCALE:GREGORIAN
BEGIN:VEVENT
DTSTAMP:20260614T174738Z
UID:3859e3b6-51c3-4ddc-914f-4eeeca1cbbd4
DTSTART:20180627T140000Z
DTEND:20180627T150000Z
DESCRIPTION:[BioSimSpace](https://biosimspace.org) is a flagship software p
 roject from the [CCP-BioSim](https://ccpbiosim.ac.uk) and [HEC-BioSim](htt
 ps://hecbiosim.ac.uk) biomolecular modelling communities. The project aims
  to make it easier for researchers to develop\, share and re-use biomolecu
 lar simulation workflow nodes. The software problem in our community is th
 at we have lots of different pieces of software that are all incompatible 
 and are not interoperable. \n\nThis forces the community to hand-write sma
 ll scripts for converting between different file formats\, or to generate 
 different software input files. The resulting scripts are specific for the
  software and task performed\, leading to the community generating lots of
  bespoke and brittle workflows. \n\nBioSimSpace solves this problem by pro
 viding an **interoperability layer** between the major molecular simulatio
 n packages. In effect\, BioSimSpace provides the shims that fill in the ga
 ps between codes. BioSimSpace Python scripts can be run from the command l
 ine\, used as workflow nodes in packages such as Knime\, or run on the clo
 ud as Jupyter notebooks. \n\nIn this talk\, we will show how BioSimSpace h
 as been implemented\, will talk about its capabilities and our future plan
 s\, and will demonstrate some BioSimSpace workflow nodes running on the cl
 oud.
SUMMARY:BioSimSpace – filling the gaps between molecular simulation codes
URL;VALUE=URI:https://bioexcel.eu/webinar-biosimspace-filling-the-gaps-betw
 een-molecular-simulation-codes-2018-06-27/
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