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Issues list

[TODO]: Proofread API docstring todo add an item to the to-do list
#855 opened May 6, 2024 by shihchengli v2.0.1
2
[v2 BUG]: LightningModule has parameters that were not used bug Something isn't working
#853 opened May 2, 2024 by clue09 v2.0.1
7
[v2 FEATURE]: hpopt learning parameters consistent with train enhancement a new feature request
#852 opened May 2, 2024 by akshatzalte v2.0.1
[v2 BUG]: Non integer values for 'batch-size' in hpopt output bug Something isn't working
#851 opened May 2, 2024 by akshatzalte v2.0.1
[v2 BUG]: MCC loss can give Nan bug Something isn't working
#846 opened Apr 29, 2024 by KnathanM v2.0.1
2
[v2 BUG]: Cross entropy loss is too big bug Something isn't working
#845 opened Apr 29, 2024 by KnathanM v2.0.1
@KnathanM
1
[v2 QUESTION]: how to run some of the old routines, e.g., multi-task, rdkit2d features and do a hyper parameter optimization of the architecture question Further information is requested
#843 opened Apr 26, 2024 by muammar v2.0.1
1
[TODO/BUG?]: add a warning to docs about all predictions being 0 with inconsistent specification of GPU devices bug Something isn't working todo add an item to the to-do list
#830 opened Apr 23, 2024 by kevingreenman v2.0.1
1
[v2 QUESTION]: SpectralFNN functionality question Further information is requested
#829 opened Apr 23, 2024 by Rhys-McAlister v2.0.1
5
[v2 BUG]: readthedocs latest doesn't successfully build from main branch bug Something isn't working
#828 opened Apr 23, 2024 by Rhys-McAlister v2.0.1
2
[TODO]: Add unit tests for recently added *Transform classes todo add an item to the to-do list
#823 opened Apr 22, 2024 by hwpang v2.1.0
[TODO]: use best model in notebooks todo add an item to the to-do list
#820 opened Apr 19, 2024 by KnathanM v2.1.0
[TODO]: Metric Improvements todo add an item to the to-do list
#817 opened Apr 19, 2024 by KnathanM v2.1.0
7
[TODO]: Add CLI tutorial pages for HPO and fingerprinting to docs todo add an item to the to-do list
#815 opened Apr 19, 2024 by kevingreenman v2.0.1
@KnathanM
[Feature]: Refactor Predictor subclasses into parameterizations via OutputTransforms enhancement a new feature request todo add an item to the to-do list
#811 opened Apr 18, 2024 by hwpang v2.1.0
[Feature]: Revamp the Transform hyperparameter loading enhancement a new feature request todo add an item to the to-do list
#810 opened Apr 18, 2024 by hwpang v2.1.0
[FEATURE]: Add option to make component order in multicomponent not matter enhancement a new feature request mlpds Issue/PR by MLPDS member (priority)
#806 opened Apr 17, 2024 by KnathanM v2.1.0
13
[TODO]: Add example notebook(s) for interoperability between chemprop and other libraries mlpds Issue/PR by MLPDS member (priority) todo add an item to the to-do list
#804 opened Apr 17, 2024 by kevingreenman v2.1.0
@hwpang
[BUG]: CI doesn't complain when notebooks fail bug Something isn't working
#798 opened Apr 16, 2024 by KnathanM v2.0.1
1
[FEATURE]: Move --ignore-columns to common args enhancement a new feature request
#793 opened Apr 13, 2024 by KnathanM v2.1.0
[FEATURE]: Cache in CLI enhancement a new feature request
#792 opened Apr 13, 2024 by KnathanM v2.1.0
@KnathanM
7
[TODO]: Add Optuna support for hyperparameter optimization enhancement a new feature request todo add an item to the to-do list
#783 opened Apr 12, 2024 by hwpang v2.1.0
[TODO]: Run tests on M1 todo add an item to the to-do list
#776 opened Apr 10, 2024 by KnathanM v2.1.0
@JacksonBurns @kevingreenman
4
[TODO]: Better documentation for common Q&As and also for developers todo add an item to the to-do list
#770 opened Apr 9, 2024 by oscarwumit v2.1.0
@joelnkn
2
[BUG (RISK?)]: v2 relies on unsupported usage of scikit-learn bug Something isn't working
#752 opened Apr 2, 2024 by JacksonBurns v2.1.0
@KnathanM
3
ProTip! What’s not been updated in a month: updated:<2024-04-11.