Issues · Packages / chemical_checker

New issue

typo in datasource name

#95 · created Apr 29, 2019 by Miquel Duran-Frigola
- CLOSED
- 1
updated Feb 15, 2022
Downloader should save the download files to a name that we specify

#94 · created Apr 26, 2019 by Oriol Guitart
- CLOSED
- 1
updated May 03, 2019
HPC capabilities for fit() and predict()

#93 · created Apr 26, 2019 by Miquel Duran-Frigola Apr 30, 2019 Package
- CLOSED
- 2
updated May 10, 2019
Database organization

#92 · created Apr 26, 2019 by Miquel Duran-Frigola Package
- CLOSED
- 4
updated Feb 15, 2022
Deprecated function

#91 · created Apr 26, 2019 by Miquel Duran-Frigola
- CLOSED
- 1
updated Feb 15, 2022
Default num_topics

#90 · created Apr 26, 2019 by Miquel Duran-Frigola Apr 26, 2019
- CLOSED
- 0
updated May 01, 2019
Memory errors

#89 · created Apr 24, 2019 by Miquel Duran-Frigola
- CLOSED
- 1
updated Apr 24, 2019
Install lxml python module into the cc image

#88 · created Apr 23, 2019 by Miquel Duran-Frigola To Do
- CLOSED
- 0
updated Apr 24, 2019
Add HMDB-related datasets

#87 · created Apr 23, 2019 by Miquel Duran-Frigola
- CLOSED
- 0
updated Feb 11, 2020
Issues map_dataset_datasource table

#86 · created Apr 23, 2019 by Miquel Duran-Frigola Package
- CLOSED
- 1
updated May 03, 2019
adanet utilities

#85 · created Apr 23, 2019 by Martino Bertoni To Do
- CLOSED
- 1
updated May 06, 2019
Current preprocess scripts may have errors

#84 · created Apr 18, 2019 by Miquel Duran-Frigola Package
- CLOSED
- 1
updated May 10, 2019
All signatures 0 need to have features

#83 · created Apr 18, 2019 by Miquel Duran-Frigola
- CLOSED
- 2
updated Jul 01, 2019
Memory error while trying to predict targets (molpropery) on large molrepo

#82 · created Apr 17, 2019 by Miquel Duran-Frigola Package
- CLOSED
- 1
updated May 03, 2019
Deduce dataset_code from folder in the run_template.py from the preprocessing

#81 · created Apr 17, 2019 by Miquel Duran-Frigola
- CLOSED
- 1
updated May 10, 2019
Do not calculate properties unless it is necessary at predict time when pre-processing

#80 · created Apr 17, 2019 by Miquel Duran-Frigola Package
- CLOSED
- 0
updated Jul 01, 2019
Change "molrepo_file" to e.g. "file_name"

#79 · created Apr 17, 2019 by Miquel Duran-Frigola
- CLOSED
- 1
updated May 03, 2019
First attempt to expand the CC, dataset B4.002

#78 · created Apr 16, 2019 by Miquel Duran-Frigola Apr 22, 2019 Package
- CLOSED
- 1
updated Apr 25, 2019
Incorrect doc in prop_calculator

#77 · created Apr 16, 2019 by Miquel Duran-Frigola Apr 17, 2019
- CLOSED
- 1
updated May 10, 2019
Illegal username when trying to work from laptop

#76 · created Apr 16, 2019 by Miquel Duran-Frigola
- CLOSED
- 1
updated Apr 17, 2019