substr_mask: Extract substructure from a molecule using mask

Description Usage Arguments Value Examples

Description

Extracts substructure from a molecule using mask.

Usage

1
substr_mask(mol, mask)

Arguments

mol

molecule

mask

mask defining substructure to be extracted

Value

Substructure

Examples

1
2
3
data("alkans74")
mol <- alkans74.mdb[[2]]
substr_mask(mol, c(1,1,0))


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