openmolecules.org

 
Home » DataWarrior » Functionality » Defining columntype while appending columns (Defining columntype while appending columns)
Re: Defining columntype while appending columns [message #2133 is a reply to message #2132] Mon, 19 February 2024 10:58 Go to previous messageGo to previous message
helloWorld22 is currently offline  helloWorld22
Messages: 13
Registered: June 2022
Junior Member
Hi Norwid,
The requirement is to add columns containing structures and my plugin retrieves the structures(SMILES or Mol File) from our internal database.
I can now append the column as a text as smiles. But I cant convert them as a structure. Unless I convert them as a structure column, I wont be able to do structure search on the existing data.

I tried : dwInterface.setColumnType and added IPluginHelper.COLUMN_TYPE_STRUCTURE_FROM_SMILES. But this doesnot work while appending column.

Is it possible to append column via SDK as structure and not text? I can also retrieve mol files, instead of SMILES, from DB, if that helps.

Thanks

[Updated on: Mon, 19 February 2024 21:51]

Report message to a moderator

 
Read Message
Read Message
Read Message
Read Message
Read Message
Previous Topic: retreive data from sqlite database?
Next Topic: Export Graph as Image
Goto Forum:
  


Current Time: Thu Nov 21 23:21:01 CET 2024

Total time taken to generate the page: 0.03442 seconds