From: Template-based combinatorial enumeration of virtual compound libraries for lipids
Command | Description |
---|---|
GLStrGen.pl “*(*:*/*:*/*:*)” | Enumerate all possible glycerolipid structures |
GLStrGen.pl “*(*:2/*:*/*:*)” | Enumerate all possible glycerolipid structures containing 2 double bonds in sn1 chains |
GLStrGen.pl “DG(*:2/*:1(9Z)/0:0)” | Enumerate all possible diglycerols structures containing 2 double bonds in sn1 chains and a specific double bond in sn2 chain |
GPStrGen.pl “*(*:*(*)/*:*(*))” | Enumerate all possible glycerophospholipid structures |
GPStrGen.pl “*(*- > 10 < 20:*/*+ > 16 < 24:*)” | Enumerate all possible glycerophospholipid structures containing sn1 chains with odd chain length > 10 and < 20, and sn2 chains with even chain length > 16 and < 24 |
GPStrGen.pl “PC(18:1(11E)/*:*)” | Enumerate all possible glycerophospholipid structures containing phosphocholine (PC) headgroup and a specific sn1 chain |
CLStrGen.pl “*(1'-[*:*/*:*],3'-[*:*/*:*])” | Enumerate all possible cardiolipin structures |
CLStrGen.pl “*(1'-[18:2(9Z,12Z)/*:*],3'-[*:*/*:*])” | Enumerate all possible cardiolipin structures containing a specific sn1 chain at 1' position |
SPStrGen.pl “*(*:*/*:*)” | Enumerate all possible sphingolipid structures |
SPStrGen.pl “*(*:*/0:0)” | Enumerate all possible sphingolipid structures without any N-acyl |
SPStrGen.pl “*(*-:*/*:*)” | Enumerate all possible sphingolipid structures containing odd long chain base lengths |
SPStrGen.pl “*(*+ > 18:*/0:0)” | Enumerate all possible sphingolipid structures containing long chain bases with even chain length > 18 and no N-acyl chain |