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I am not sure if the following behavior is intended:
```
> cat matbench-scores-bug.py
from matbench.data_ops import score_array, CLF_KEY
from sklearn.metrics import roc_auc_score
true_array =…
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**Project details:**
See below.
**Additional context:**
This is a tricky subject. Materials repositories. Should they be part of this list, or rather be in a separate "materials inform…
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### Email (Optional)
_No response_
### Problem
In this [example](https://github.com/materialsproject/crystaltoolkit/blob/main/crystal_toolkit/apps/examples/basic_hello_structure_interactive.py), if…
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I have been downloading a large amount of GGA/GGA+U entries for binary systems, and something I have noticed is that **all** systems containing 'Yb' as one of the two elements are missing the element …
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Maybe worth mentioning in the `v0.24.0` release or updating `mpr.summary.available_fields` (which still shows `nsites`, no reference to `num_sites`), since `nsites` produces an unexpected keyword erro…
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I am trying to use the OPTIMADE Rester. But when running the following lines
`from pymatgen.ext.optimade import OptimadeRester
opt = OptimadeRester('mp')
data = opt.get_structures(elements=['…
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#### Problem
For molecular dynamics simulation and machine learning data generation of random structures, one might desire to have a routine that transforms a given disordered structure $S$ to a se…
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Note that I'm unaffiliated
See https://matbench.materialsproject.org/
> [Matbench](https://doi.org/10.1038/s41524-020-00406-3) is an [ImageNet](http://www.image-net.org/) for materials science; …
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Currently `update_launchpad_data` applies only to `["launches", "fireworks", "workflows"]` but omits the `"tasks"` collection. Is this a deliberate decision? Any reason `"tasks"` should not be changed…
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@MahamadSalah74 I ran the [matbench notebook](https://github.com/materialsproject/matbench/blob/main/benchmarks/matbench_v0.1_CrabNet/notebook.ipynb) posted on the matbench GitHub page (https://github…