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Update README with conda-forge installation
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RaulPPelaez committed Oct 25, 2023
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Expand Up @@ -13,15 +13,22 @@ TorchMD-NET provides state-of-the-art neural networks potentials (NNPs) and a me
- [TensorNet](https://arxiv.org/abs/2306.06482)


## Installation
## Installation
TorchMD-Net is available in [conda-forge](https://conda-forge.org/) and can be installed with:
```shell
mamba install torchmd-net
```
We recommend using [Mamba](https://github.com/conda-forge/miniforge/#mambaforge) instead of conda.

### Install from source

1. Clone the repository:
```shell
git clone https://github.com/torchmd/torchmd-net.git
cd torchmd-net
```

2. Install [Mambaforge](https://github.com/conda-forge/miniforge/#mambaforge). We recommend to use `mamba` rather than `conda`.
2. Install the dependencies in environment.yml. You can do it via pip, but we recommend [Mambaforge](https://github.com/conda-forge/miniforge/#mambaforge) instead.

3. Create an environment and activate it:
```shell
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