CrystalCMP
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F60461373%3A22310%2F10%3A00023744" target="_blank" >RIV/60461373:22310/10:00023744 - 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
CrystalCMP
Original language description
CrystalCMP is a code, which computes fingerprints (1D or 2D plots) that can be used for the similarity classification of crystal structures. The fingerprint can be pair-distribution function and pair-distribution function combined with angles. The code compares these fingerprints among each other and it computes the similarity matrix. As the final step the cluster analysis is used for showing the similar results. The source code and the last version is available on the sourceforge web - https://sourceforge.net/projects/crystalcmp
Czech name
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Czech description
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Classification
Type
R - Software
CEP classification
BM - Solid-state physics and magnetism
OECD FORD branch
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Result continuities
Project
<a href="/en/project/2B08021" target="_blank" >2B08021: NMR crystallography of active pharmaceuticals ingredients for industrial applications</a><br>
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>S - Specificky vyzkum na vysokych skolach
Others
Publication year
2010
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Internal product ID
CrystalCPM
Technical parameters
Podpora Windows a Linux OS
Economical parameters
snížení nákladů na polymorfní screening (vývoj nových fází)
Owner IČO
60461373
Owner name
VŠCHT Praha