Description Usage Arguments Author(s)
Build lipid library based on sdf file and smile file
1 2 | LipLibBuild(sdf.file, smile.file, category = "GP", is.output = TRUE,
output.address = NULL)
|
sdf.file |
The file name of sdf file |
smile.file |
The file name of smile file |
category |
The category of lipids. "GP": Glycerophospholipids; "SP": Sphingolipids; "GL": Glycerolipids; The default is "GP" |
is.output |
The output csv file. The default is TRUE. |
output.address |
The output address of csv file. The default is NULL. |
Zhiwei Zhou zhouzw@sioc.ac.cn
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