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Generating Hyperspace input [message #1992]

Thu, 24 August 2023 17:25

and_tos
Messages: 1
Registered: August 2023

Junior Member

Hi,

I am very interested in using the recently published Hyperspace search and was wondreing how to proceed to generate the input from a list of building blocks. I am completely new to DataWarrior and unfamiliar with Java. So far I managed to create a Virtual Fragment Space as described in the publication by Wahl and Sanders.

I can load the space.dwar file in to DataWarrior and see the synthons and reactions. Now I am wondering how to export these to a text file in the appropriate format for the hyperspace search. Any advice would be highly appreciated!

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Generating Hyperspace input

By: and_tos on Thu, 24 August 2023 17:25

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