This is the Linux app named MolecularGraph.jl whose latest release can be downloaded as v0.19.1sourcecode.tar.gz. It can be run online in the free hosting provider OnWorks for workstations.
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MolecularGraph.jl
PRODUCTBESCHRIJVING
MolecularGraph.jl is a graph-based molecule modeling and chemoinformatics analysis toolkit fully implemented in Julia.
Kenmerken
- Considerations in molecular graph implementation
- Built-in molecule properties and descriptors
- 2D structure image drawing and export to SVG
- SDFile reader/writer (.sdf, .mol)
- Properties and descriptors
- Maximum common substructure (MCS)
Programmeertaal
Julia
Categorieën
This is an application that can also be fetched from https://sourceforge.net/projects/moleculargraph-jl.mirror/. It has been hosted in OnWorks in order to be run online in an easiest way from one of our free Operative Systems.
