About: Molpher     Goto   Sponge   NotDistinct   Permalink

An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

AttributesValues
rdf:type
rdfs:seeAlso
Description
  • Molpher aims to be a scalable interactive software framework to aid the exploration of the chemical space. Given a source/target molecular pair, Molpher explores their structural neighbourhood via a process called molecular morphing. Molecular morphing generates a path in the chemical space by an iterative application of morphing operators that represent simple structural changes (such as, e.g., add or remove atom). This path consting of molecules called morphs and its surroundings constitutes a virtual chemical library focused on a mechanistic class of compounds given by the characteristics of the source/target pair.
  • Molpher aims to be a scalable interactive software framework to aid the exploration of the chemical space. Given a source/target molecular pair, Molpher explores their structural neighbourhood via a process called molecular morphing. Molecular morphing generates a path in the chemical space by an iterative application of morphing operators that represent simple structural changes (such as, e.g., add or remove atom). This path consting of molecules called morphs and its surroundings constitutes a virtual chemical library focused on a mechanistic class of compounds given by the characteristics of the source/target pair. (en)
Title
  • Molpher
  • Molpher (en)
skos:prefLabel
  • Molpher
  • Molpher (en)
skos:notation
  • RIV/00216208:11320/14:10281840!RIV15-GA0-11320___
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(GP14-29032P)
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
http://linked.open.../riv/druhVysledku
http://linked.open...iv/duvernostUdaju
http://linked.open...onomickeParametry
  • Free academic software
http://linked.open...titaPredkladatele
http://linked.open...dnocenehoVysledku
  • 30330
http://linked.open...ai/riv/idVysledku
  • RIV/00216208:11320/14:10281840
http://linked.open...terniIdentifikace
  • molpher-1.0
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • drug discovery; chemical space exploration; cheminformatics (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...ontrolniKodProRIV
  • [3911C2A72C72]
http://linked.open...in/vavai/riv/obor
http://linked.open...ichTvurcuVysledku
http://linked.open...cetTvurcuVysledku
http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...echnickeParametry
  • stand-alone klient-server aplikace
http://linked.open...iv/tvurceVysledku
  • Hoksza, David
  • Škoda, Petr
http://linked.open...avai/riv/vlastnik
http://linked.open...itiJinymSubjektem
http://localhost/t...ganizacniJednotka
  • 11320
Faceted Search & Find service v1.16.116 as of Feb 22 2024


Alternative Linked Data Documents: ODE     Content Formats:   [cxml] [csv]     RDF   [text] [turtle] [ld+json] [rdf+json] [rdf+xml]     ODATA   [atom+xml] [odata+json]     Microdata   [microdata+json] [html]    About   
This material is Open Knowledge   W3C Semantic Web Technology [RDF Data] Valid XHTML + RDFa
OpenLink Virtuoso version 07.20.3239 as of Feb 22 2024, on Linux (x86_64-pc-linux-gnu), Single-Server Edition (126 GB total memory, 67 GB memory in use)
Data on this page belongs to its respective rights holders.
Virtuoso Faceted Browser Copyright © 2009-2024 OpenLink Software