FastGrid -- The Accelerated Computation of Potential Maps for Molecular Docking
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216224%3A14310%2F09%3A00037314" target="_blank" >RIV/00216224:14310/09:00037314 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Alternative languages
Result language
angličtina
Original language name
FastGrid -- The Accelerated Computation of Potential Maps for Molecular Docking
Original language description
FastGrid is a fork of AutoGrid, which computes grid maps of interaction energies for various atom types around a macromolecule. These grid maps are then used by AutoDock docking calculations to determine the total interaction energy for a ligand with a macromolecule. FastGrid is meant to be a replacement of AutoGrid, having the same behavior as AutoGrid 4.2.1, and being more than 100x faster depending on a molecule and grid map size.
Czech name
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Czech description
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Classification
Type
R - Software
CEP classification
IN - Informatics
OECD FORD branch
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Result continuities
Project
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Continuities
Z - Vyzkumny zamer (s odkazem do CEZ)<br>S - Specificky vyzkum na vysokych skolach
Others
Publication year
2009
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Internal product ID
FastGrid 1.0
Technical parameters
Program pro předvýpočet potenciálových map kompatibilních s balíkem AutoDock. Platforma: PC, linux
Economical parameters
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Owner IČO
00216224
Owner name
Masarykova univerzita