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This curated list contains 38 awesome open-source projects with a total of 3.8K stars grouped into 0 categories. All projects are ranked by a project-quality score, which is calculated based on various metrics automatically collected from GitHub and different package managers. If you like to add or update projects, feel free to open an [issue](https://github.com/deepmodeling/deepmodeling-projects/issues/new/choose), submit a [pull request](https://github.com/deepmodeling/deepmodeling-projects/pulls), or directly edit the [projects.yaml](https://github.com/deepmodeling/deepmodeling-projects/edit/main/projects.yaml). Contributions are very welcome!
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This curated list contains 38 awesome open-source projects with a total of 3.9K stars grouped into 0 categories. All projects are ranked by a project-quality score, which is calculated based on various metrics automatically collected from GitHub and different package managers. If you like to add or update projects, feel free to open an [issue](https://github.com/deepmodeling/deepmodeling-projects/issues/new/choose), submit a [pull request](https://github.com/deepmodeling/deepmodeling-projects/pulls), or directly edit the [projects.yaml](https://github.com/deepmodeling/deepmodeling-projects/edit/main/projects.yaml). Contributions are very welcome!
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> 🧙♂️ Discover other [best-of lists](https://best-of.org) or [create your own](https://github.com/best-of-lists/best-of/blob/main/create-best-of-list.md).
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@@ -51,15 +51,15 @@ This curated list contains 38 awesome open-source projects with a total of 3.8K
@@ -104,19 +104,19 @@ This curated list contains 38 awesome open-source projects with a total of 3.8K
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docker pull dptechnology/dpdata
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```
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</details>
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<details><summary><b><ahref="https://github.com/deepmodeling/abacus-develop">ABACUS</a></b> (🥇24 · ⭐ 190 · 📉) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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<details><summary><b><ahref="https://github.com/deepmodeling/abacus-develop">ABACUS</a></b> (🥇24 · ⭐ 190) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
<details><summary><b><ahref="https://github.com/deepmodeling/dpdispatcher">dpdispatcher</a></b> (🥈22 · ⭐ 48) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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<details><summary><b><ahref="https://github.com/deepmodeling/dpdispatcher">dpdispatcher</a></b> (🥈22 · ⭐ 49) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
<details><summary><b><ahref="https://github.com/deepmodeling/dargs">dargs</a></b> (🥈17 · ⭐ 5) - Argument processing for the deep modeling project. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
@@ -196,37 +196,49 @@ This curated list contains 38 awesome open-source projects with a total of 3.8K
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conda install -c conda-forge dargs
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```
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</details>
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<details><summary><b><ahref="https://github.com/deepmodeling/dpgen2">DPGEN2</a></b> (🥈15 · ⭐ 34) - 2nd generation of the Deep Potential GENerator. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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<details><summary><b><ahref="https://github.com/deepmodeling/dpgen2">DPGEN2</a></b> (🥈15 · ⭐ 35) - 2nd generation of the Deep Potential GENerator. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
<details><summary><b><ahref="https://github.com/deepmodeling/DeePTB">DeePTB</a></b> (🥈14 · ⭐ 64) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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<details><summary><b><ahref="https://github.com/deepmodeling/dpgui">DP-GUI</a></b> (🥈15 · ⭐ 7 · 📈) - A web-based GUI for user inputs. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
<details><summary><b><ahref="https://github.com/deepmodeling/DeePTB">DeePTB</a></b> (🥈14 · ⭐ 66) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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pip install dptb
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```
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</details>
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<details><summary><b><ahref="https://github.com/deepmodeling/dpgui">DP-GUI</a></b> (🥈14 · ⭐ 7) - A web-based GUI for user inputs. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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<details><summary><b><ahref="https://github.com/deepmodeling/jax-fem">JAX-FEM</a></b> (🥈13 · ⭐ 350 · 📈) - Differentiable Finite Element Method with JAX. <code><ahref="http://bit.ly/2M0xdwT">GPL-3.0</a></code></summary>
<details><summary><b><ahref="https://github.com/deepmodeling/DMFF">DMFF</a></b> (🥈13 · ⭐ 170 · 💤) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
<details><summary><b><ahref="https://github.com/deepmodeling/DeepH-pack">DeepH-pack</a></b> (🥉4 · ⭐ 12 · 💤) - Deep neural networks for density functional theory Hamiltonian. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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<details><summary><b><ahref="https://github.com/deepmodeling/DeepH-pack">DeepH-pack</a></b> (🥉4 · ⭐ 13 · 💤) - Deep neural networks for density functional theory Hamiltonian. <code><ahref="http://bit.ly/37RvQcA">LGPL-3.0</a></code></summary>
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