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  • One of the problems connected with a real-time protein-ligand docking simulation is the need to store series of precomputed electrostatic force fields of a molecule changing in time. A single frame of the force field is a 3D array of floating point vectors and it constitutes approximately 180 MB of data. Therefore requirements on storage grow rapidly if several hundreds of such frames need to be stored. We propose a lossy compression method of such force field, based on audio and video coding, and we evaluate its properties and performance.
  • One of the problems connected with a real-time protein-ligand docking simulation is the need to store series of precomputed electrostatic force fields of a molecule changing in time. A single frame of the force field is a 3D array of floating point vectors and it constitutes approximately 180 MB of data. Therefore requirements on storage grow rapidly if several hundreds of such frames need to be stored. We propose a lossy compression method of such force field, based on audio and video coding, and we evaluate its properties and performance. (en)
Title
  • Compression of Vector Field Changing in Time
  • Compression of Vector Field Changing in Time (en)
skos:prefLabel
  • Compression of Vector Field Changing in Time
  • Compression of Vector Field Changing in Time (en)
skos:notation
  • RIV/00216224:14610/11:00052110!RIV12-MSM-14610___
http://linked.open...avai/predkladatel
http://linked.open...avai/riv/aktivita
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  • Z(MSM0021622419)
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
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  • 191474
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  • RIV/00216224:14610/11:00052110
http://linked.open...riv/jazykVysledku
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  • haptics; molecular docking; lossy compression (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...ontrolniKodProRIV
  • [B62CD831B6E0]
http://linked.open...v/mistoKonaniAkce
  • Mikulov
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  • Dagstuhl
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  • Sixth Doctoral Workshop on Mathematical and Engineering Methods in Computer Science
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  • Golembiovský, Tomáš
  • Křenek, Aleš
http://linked.open...vavai/riv/typAkce
http://linked.open.../riv/zahajeniAkce
http://linked.open...n/vavai/riv/zamer
issn
  • 2190-6807
number of pages
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  • Schloss Dagstuhl--Leibniz-Zentrum fuer Informatik
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  • 978-3-939897-22-4
http://localhost/t...ganizacniJednotka
  • 14610
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