openmolecules.org

 
Home » DataWarrior » Functionality » How to use "Create Combinatorial Library" function?
How to use "Create Combinatorial Library" function? [message #152] Tue, 23 February 2016 19:32 Go to previous message
Data_Center is currently offline  Data_Center
Messages: 1
Registered: February 2016
Junior Member
I have just started using Data Warrior and I couldn't correctly deploy "Create Combinatorial Library" function. I used a generic reaction of a carboxlic acid with an amine to form an amide bond. Then I used 11 carboxylic acids and eight amines but all the 88 products were filled with the structure of the generic product not the ones from the lists I provided. Any help. I have attached the list of the generic reaction I used along with the files of acids and amines. If anyone knows what is going, please share your thoughts and I appreciate your help.
 
Read Message
Read Message
Previous Topic: Drawing Multi-step reaction schemes.
Next Topic: dwaq file format
Goto Forum:
  


Current Time: Thu Apr 25 07:09:01 CEST 2024

Total time taken to generate the page: 0.04531 seconds