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> jonathan@iMac-Jonathan ~ brew install cgminer
> Updating Homebrew...
> ==> Auto-updated Homebrew!
> Updated 2 taps (homebrew/core, homebrew/php).
> ==> New Formulae
> bitcoin …
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**Describe the bug**
I have just observed this test fail locally in my 0.20 development environment with the following output:
```
FAILED python/cuml/test/test_random_forest.py::test_rf_classific…
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**Describe the bug**
For specific training and test inputs to `LinearRegression`, cuml and sklearn produce significantly different outputs
**Steps/Code to reproduce bug**
```python
import cupy a…
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Please run these steps (works on mac os with Docker desktop)
Note I also tried to specify a locked down version with --version 2.1.3 but it doesn't help.
```
printf "FROM docker.elastic.co/logsta…
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Let's add an integration test suite to BespokeFit.
BespokeFit has good unit-test coverage, but much of its behavior is non-local. The 0.2.0 release was broken because of a bug in ForceBalance which…
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Hi, I am trying to get bespoke torsions for the molecule ```CNC(=O)[C@H](CCC\C=C/CCC[C@H](NC(C)=O)C(=O)NC)NC(C)=O```. However, the QC generation step exits with the following message:
```
3. runnin…
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asdf is gaining popularity as a version manager of all sorts, and we should be able to hook into it.
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**Describe the bug**
Chemically equivalent atoms in which a nonzero charge is delocalized (represented by resonance structures with the formal charge on different atoms) are assigned different torsio…
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**Describe the bug**
Parsing a ForceField and rewriting it a to file changes the `parameterize` field on some Angles from `k` to `1 * boltzmann_constant ** 1`, upsetting ForceBalance.
**To Repro…
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Trying to use the pre-trained espaloma-0.3.0 on my supercell, and came across this vague error that I can't seem to get the origin of?
```
/home/hy2120/miniconda/envs/openff/lib/python3.10/site-pa…