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Collect the known actives (positive controls) for retrospective analysis. For a given target, these can be found in the scientific literature, patent literature or public databases such as IUPHAR/BPS[…
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The merging of multiple records in source databases into a single record in mychem.info is a challenging process, and one where I doubt we'll ever get it perfectly "right". Having said that, I notice…
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Related to #51.
### Move workflow to a separate repository: ###
- [x] [TUCAN-nest/ChEMBL-test](https://github.com/TUCAN-nest/ChEMBL-test)
### Separate Snakemake rules and Python code: ###
At t…
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Hello,
Unfortunately, the ER diagram does not follow the Normal Form rules and has many errors. It means the resultsets from the JOIN queries are not reliable.
Best,
Saed
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I find that information redundant. Some of the names in Trade names are already in ChEMBL synonyms. Would it be possible to have just "Synonyms"?
Thank you,
Mila
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while running get_vocab.py on an experiment dataset of the first 40 lines in data/chembl/all.txt , i get the following error message :
I've tried going to the respective line in chem_utils.py an…
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From https://openphacts2011.atlassian.net/browse/EXPLORER-30
Feedback shows that the current form of the tsv file is not very useful to the end user. It would be good if the export format can be chang…
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报错FileNotFoundError: [Errno 2] No such file or directory: 'data_drug/chembl_30.csv',这个文件在哪里呢
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Dear ChEMBL staff,
comparing standard_value records with same TID, MOLREGNO and standard_type, yields several values within reasonable experimental errors,
however a large number of differences resu…
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Example query: https://www.ebi.ac.uk/chembl/api/data/drug_indication.json?molecule_chembl_id=CHEMBL25
ChEMBL API docs: https://www.ebi.ac.uk/chembl/api/data/docs
Example output:
```
{
"drug…