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Further to the first set of compounds prepared by [Jessica Baiget ](https://github.com/OpenSourceTB/OSTB_Series_3/wiki/First-Set-of-Compounds) and those [inherited from GSK](https://github.com/OpenSou…
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**Describe the bug**
According to the 0.2 spec, schema:author must appear at least once.
In the [workflow-0.2](https://github.com/ResearchObject/ro-crate/blob/master/examples/workflow-0.2.0/ro…
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Hi,
I would like to ask if it is still necessary to use prefixes to differentiate tasks when using a multi-task approach. I found a file named MultiTask.py,it seems without use of the prefix.
Th…
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**Date**: Apr 12th
**Time**: 2pm UK time ([other times](https://www.timeanddate.com/worldclock/meetingdetails.html?year=2022&month=3&day=8&hour=14&min=0&sec=0&p1=43&p2=136&p3=37&p4=771&p5=235&p6=240&…
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Hello, @SGenheden ,Nice to meet you again!
I have another question, could you give me some advice? Thanks a lot.
when using aizynthfinder, is there a way to guide the routes genereated with rea…
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Hello,
following the intructions of README, I finally get a forward and a backward model trained using [rxn-onmt-models] and USPTO FULL dataset, but no results are returned when run the last comma…
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Hi,
When I use RXN4ChemistryWrapper, I can get "response" and "results" correctly, and "create_synthesis_from_sequence" is also correct. But then when I use "get_node_ids" and "get_reaction_setting…
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I have some target compounds(SMILES), but I have no idea how to use your tool to break it down into some reactants.Any help would be appreciated.
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Hi,
GOOD Work!
I m trying to extract reaction templates of other chemical reactions via your code.
The chemical reactions were atom mapped, but not santisfy atomic conservation. Can it work c…
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running the plotting.py script produce a error cause par.json is not provided.
Also jupyter installation is needed to run plotting.
Installation: on linux
````
(evalretro) ubuntu@l4-ubuntu22…