-
Following these steps:
```
git clone https://github.com/lab-cosmo/metatensor-models
cd metatensor-models
pip install .
```
An error came out during the installation. Any suggestion to solve …
-
**Submitting author:** @samwaseda (Osamu Waseda)
**Repository:** https://github.com/samwaseda/mamonca
**Branch with paper.md** (empty if default branch): joss-paper
**Version:** 0.0.8
**Editor:** @kel…
-
Not sure whether that's a problem on our end, but to make sure, I'll post here anyway:
a number of videos have always failed in thumbnail creation, but I have never seen it that (six) consecutive fil…
-
#3 is changing the naming to `metatensor_models`. I feel like `metatensor-models` is more in line with our other packages
-
Dear authors,
The provided paper is comprehensive and well-written. However, these comments may help improve it:
* As mentioned in the paper, there exists other packages for multi-scale coupling s…
-
Hi, following up from the previous issue in https://github.com/openmm/openmm-torch/issues/130.
Increasing the number of neighbours worked and I can now run simulations with my trained models. Howev…
-
To allow future comparisons between neural networks we need an interface between SchNetPack and Q|R.
SchNetPack: https://github.com/atomistic-machine-learning/schnetpack
Documentation: https://s…
-
### Describe the feature
以往收藏的arxiv文章可能会随着时间的流逝,某些文章已经在相关期刊发表,希望增加直接更新此类已发表文章的条目元数据的功能,感谢
### Additional context
烦请增加该功能以便于期刊的引用
-
Posting the same issue in the torchmd-net repo as it might be a joint issue.
I am trying to train a NNP on chignolin trajectories in explicit solvent with TorchMD-Net, which I then plan to use in O…
-
pip fails building wheel within environments having latest python versions 3.11 and 3.12.
Command to build/install: ` pip install git+https://github.com/lab-cosmo/librascal`
| Python | Build
|…