diff --git a/README.md b/README.md index b881e73..0db40b4 100644 --- a/README.md +++ b/README.md @@ -15,7 +15,7 @@

-This curated list contains 36 awesome open-source projects with a total of 3K 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! +This curated list contains 36 awesome open-source projects with a total of 3.1K 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! > 🧙‍♂️ 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). @@ -46,20 +46,20 @@ This curated list contains 36 awesome open-source projects with a total of 3K st
DeePMD-kit (🥇29 · ⭐ 1.4K) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 68 · 🔀 460 · 📥 35K · 📦 13 · 📋 640 - 15% open · ⏱️ 06.04.2024): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 68 · 🔀 460 · 📥 35K · 📦 13 · 📋 650 - 15% open · ⏱️ 06.04.2024): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 1.6K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 1.8K / month): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 500K · ⏱️ 07.04.2024): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 510K · ⏱️ 07.04.2024): ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 8 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 6 / month): ``` npm install deepmd-kit ``` @@ -75,7 +75,7 @@ This curated list contains 36 awesome open-source projects with a total of 3K st ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 690 / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 760 / month): ``` pip install dpgen ``` @@ -91,11 +91,11 @@ This curated list contains 36 awesome open-source projects with a total of 3K st ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 17K / month): +- [PyPi](https://pypi.org/project/dpdata) (📥 15K / month): ``` pip install dpdata ``` -- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 65K · ⏱️ 03.04.2024): +- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 66K · ⏱️ 03.04.2024): ``` conda install -c conda-forge dpdata ``` @@ -106,28 +106,28 @@ This curated list contains 36 awesome open-source projects with a total of 3K st
ABACUS (🥇23 · ⭐ 140) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 110 · 🔀 110 · 📋 1.4K - 13% open · ⏱️ 18.04.2024): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 110 · 🔀 110 · 📋 1.4K - 14% open · ⏱️ 24.04.2024): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 25K · ⏱️ 13.04.2024): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 28K · ⏱️ 13.04.2024): ``` conda install -c conda-forge abacus ```
dpdispatcher (🥈22 · ⭐ 38) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 44 · 🔀 50 · 📦 47 · 📋 69 - 23% open · ⏱️ 13.04.2024): +- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 44 · 🔀 50 · 📦 47 · 📋 69 - 23% open · ⏱️ 22.04.2024): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.5K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.6K / month): ``` pip install dpdispatcher ``` -- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 7.2K · ⏱️ 21.01.2024): +- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 7.4K · ⏱️ 21.01.2024): ``` conda install -c conda-forge dpdispatcher ``` @@ -138,12 +138,12 @@ This curated list contains 36 awesome open-source projects with a total of 3K st
reacnetgenerator (🥈20 · ⭐ 58) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 33 · 📦 1 · 📋 120 - 4% open · ⏱️ 16.04.2024): +- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 33 · 📋 120 - 4% open · ⏱️ 25.04.2024): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 410 / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 1.9K / month): ``` pip install reacnetgenerator ``` @@ -172,14 +172,26 @@ This curated list contains 36 awesome open-source projects with a total of 3K st docker pull dptechnology/dflow ```
+
DeePTB (🥈17 · ⭐ 32 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 9 · 🔀 12 · 📋 22 - 4% open · ⏱️ 24.04.2024): + + ``` + git clone https://github.com/deepmodeling/DeePTB + ``` +- [PyPi](https://pypi.org/project/dptb) (📥 390 / month): + ``` + pip install dptb + ``` +
dargs (🥈17 · ⭐ 5) - Argument processing for the deep modeling project. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 2 · 📦 110 · 📋 7 - 14% open · ⏱️ 14.04.2024): +- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 2 · 📦 110 · 📋 7 - 14% open · ⏱️ 18.04.2024): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 25K / month): +- [PyPi](https://pypi.org/project/dargs) (📥 21K / month): ``` pip install dargs ``` @@ -190,24 +202,12 @@ This curated list contains 36 awesome open-source projects with a total of 3K st
DeepFlame (🥈16 · ⭐ 120) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 23 · 🔀 55 · 📋 43 - 34% open · ⏱️ 07.04.2024): +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 23 · 🔀 55 · 📋 43 - 34% open · ⏱️ 21.04.2024): ``` git clone https://github.com/deepmodeling/deepflame-dev ```
-
DeePTB (🥈16 · ⭐ 32 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 9 · 🔀 12 · 📋 21 - 9% open · ⏱️ 15.04.2024): - - ``` - git clone https://github.com/deepmodeling/DeePTB - ``` -- [PyPi](https://pypi.org/project/dptb) (📥 290 / month): - ``` - pip install dptb - ``` -
DP-GUI (🥈15 · ⭐ 7) - A web-based GUI for user inputs. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 3 · 🔀 4 · 📦 6 · ⏱️ 12.04.2024): @@ -215,39 +215,51 @@ This curated list contains 36 awesome open-source projects with a total of 3K st ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 15K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 13K / month): ``` pip install dpgui ```
DMFF (🥈14 · ⭐ 140) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 14 · 🔀 40 · 📋 25 - 40% open · ⏱️ 12.01.2024): +- [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 14 · 🔀 40 · 📋 25 - 36% open · ⏱️ 12.01.2024): ``` git clone https://github.com/deepmodeling/DMFF ``` -- [Conda](https://anaconda.org/conda-forge/dmff) (📥 200 · ⏱️ 06.01.2024): +- [Conda](https://anaconda.org/conda-forge/dmff) (📥 230 · ⏱️ 06.01.2024): ``` conda install -c conda-forge dmff ```
-
DPGEN2 (🥈14 · ⭐ 28 · 📈) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +
DPGEN2 (🥈14 · ⭐ 28) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 13 · 🔀 19 · 📦 2 · 📋 27 - 37% open · ⏱️ 17.04.2024): +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 13 · 🔀 19 · 📦 2 · 📋 27 - 37% open · ⏱️ 19.04.2024): ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 100 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 120 / month): ``` pip install dpgen2 ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 2.4K · ⏱️ 17.04.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 2.4K · ⏱️ 19.04.2024): ``` docker pull dptechnology/dpgen2 ```
+
JAX-FEM (🥈13 · ⭐ 140 · 🐣) - Differentiable Finite Element Method with JAX. GPL-3.0 + +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 7 · 🔀 28 · 📋 22 - 77% open · ⏱️ 25.04.2024): + + ``` + git clone https://github.com/deepmodeling/jax-fem + ``` +- [PyPi](https://pypi.org/project/jax-fem) (📥 170 / month): + ``` + pip install jax-fem + ``` +
rid-kit (🥈13 · ⭐ 42 · 💤) - Reinforced dynamics. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 21 · 📥 140 · ⏱️ 22.09.2023): @@ -255,57 +267,57 @@ This curated list contains 36 awesome open-source projects with a total of 3K st ``` git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 36 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 85 / month): ``` pip install rid-kit ```
-
JAX-FEM (🥈12 · ⭐ 140 · 🐣) - Differentiable Finite Element Method with JAX. GPL-3.0 +
args (🥉12 · ⭐ 2) - DeepModeling dargs arguments generation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 7 · 🔀 27 · 📋 20 - 80% open · ⏱️ 15.04.2024): +- [GitHub](https://github.com/deepmodeling/args) (👨‍💻 3 · 🔀 2 · 📦 5 · ⏱️ 11.04.2024): ``` - git clone https://github.com/deepmodeling/jax-fem + git clone https://github.com/deepmodeling/args ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 90 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 320 / month): ``` - pip install jax-fem + npm install @deepmodeling/args ```
-
APEX (🥈12 · ⭐ 13 · 📈) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +
deepmodeling_sphinx (🥉12 · ⭐ 2) - Sphinx extension for DeepModeling projects. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 14 · ⏱️ 07.04.2024): +- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 7 · 🔀 6 · ⏱️ 18.04.2024): ``` - git clone https://github.com/deepmodeling/APEX + git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 150 / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.5K / month): ``` - pip install apex-flow + pip install deepmodeling_sphinx ```
-
args (🥈12 · ⭐ 2 · 📈) - DeepModeling dargs arguments generation. LGPL-3.0 +
APEX (🥉11 · ⭐ 13 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/args) (👨‍💻 3 · 🔀 2 · 📦 5 · ⏱️ 11.04.2024): +- [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 6 · 🔀 14 · ⏱️ 07.04.2024): ``` - git clone https://github.com/deepmodeling/args + git clone https://github.com/deepmodeling/APEX ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 340 / month): +- [PyPi](https://pypi.org/project/apex-flow) (📥 69 / month): ``` - npm install @deepmodeling/args + pip install apex-flow ```
-
deepmodeling_sphinx (🥈12 · ⭐ 2) - Sphinx extension for DeepModeling projects. LGPL-3.0 +
fealpy (🥉11 · ⭐ 2 · 📈) - Finite Element Analysis Library in Python. Unlicensed -- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 7 · 🔀 6 · ⏱️ 13.04.2024): +- [GitHub](https://github.com/deepmodeling/fealpy) (👨‍💻 57 · 🔀 2 · ⏱️ 24.04.2024): ``` - git clone https://github.com/deepmodeling/deepmodeling_sphinx + git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.7K / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 160 / month): ``` - pip install deepmodeling_sphinx + pip install fealpy ```
DeePKS-kit (🥉10 · ⭐ 97) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 @@ -316,30 +328,18 @@ This curated list contains 36 awesome open-source projects with a total of 3K st git clone https://github.com/deepmodeling/deepks-kit ```
-
dpti (🥉10 · ⭐ 18 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 +
dpti (🥉10 · ⭐ 18) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 16 · 🔀 20 · ⏱️ 13.04.2024): ``` git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/dpti) (📥 25 / month): +- [PyPi](https://pypi.org/project/dpti) (📥 22 / month): ``` pip install dpti ```
-
fealpy (🥉9 · ⭐ 2) - Finite Element Analysis Library in Python. Unlicensed - -- [GitHub](https://github.com/deepmodeling/fealpy) (👨‍💻 57 · 🔀 2 · ⏱️ 29.03.2024): - - ``` - git clone https://github.com/deepmodeling/fealpy - ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 100 / month): - ``` - pip install fealpy - ``` -
Uni-Fold (🥉8 · ⭐ 90 · 💤) - Apache-2 - [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): @@ -347,7 +347,7 @@ This curated list contains 36 awesome open-source projects with a total of 3K st ``` git clone https://github.com/deepmodeling/Uni-Fold ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 590 · ⏱️ 08.01.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 610 · ⏱️ 08.01.2024): ``` docker pull dptechnology/unifold ``` @@ -388,6 +388,14 @@ This curated list contains 36 awesome open-source projects with a total of 3K st git clone https://github.com/deepmodeling/docs ```
+
Blog (🥉7 · ⭐ 1 · 📈) - DeepModeling Blog. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 7 · 🔀 7 · ⏱️ 18.04.2024): + + ``` + git clone https://github.com/deepmodeling/blog + ``` +
AI4Science101 (🥉6 · ⭐ 82 · 💤) - AI for Science. Unlicensed - [GitHub](https://github.com/deepmodeling/AI4Science101) (👨‍💻 5 · 🔀 13 · ⏱️ 04.09.2022): @@ -412,14 +420,6 @@ This curated list contains 36 awesome open-source projects with a total of 3K st git clone https://github.com/deepmodeling/AIS-Square ```
-
Blog (🥉6 · ⭐ 1 · 📉) - DeepModeling Blog. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 7 · 🔀 7 · ⏱️ 11.04.2024): - - ``` - git clone https://github.com/deepmodeling/blog - ``` -
DeepH-pack (🥉5 · ⭐ 11) - Deep neural networks for density functional theory Hamiltonian. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/DeepH-pack) (👨‍💻 6 · 🔀 6 · 📋 6 - 66% open · ⏱️ 28.12.2023): diff --git a/history/2024-04-25_changes.md b/history/2024-04-25_changes.md new file mode 100644 index 0000000..4ca5a90 --- /dev/null +++ b/history/2024-04-25_changes.md @@ -0,0 +1,15 @@ +## 📈 Trending Up + +_Projects that have a higher project-quality score compared to the last update. There might be a variety of reasons, such as increased downloads or code activity._ + +- DeePTB (🥈17 · ⭐ 32 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +- JAX-FEM (🥈13 · ⭐ 140 · 🐣) - Differentiable Finite Element Method with JAX. GPL-3.0 +- fealpy (🥉11 · ⭐ 2 · 📈) - Finite Element Analysis Library in Python. Unlicensed +- Blog (🥉7 · ⭐ 1 · 📈) - DeepModeling Blog. LGPL-3.0 + +## 📉 Trending Down + +_Projects that have a lower project-quality score compared to the last update. There might be a variety of reasons such as decreased downloads or code activity._ + +- APEX (🥉11 · ⭐ 13 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 + diff --git a/history/2024-04-25_projects.csv b/history/2024-04-25_projects.csv new file mode 100644 index 0000000..4ab0cd9 --- /dev/null +++ b/history/2024-04-25_projects.csv @@ -0,0 +1,37 @@ +,name,github_id,pypi_id,conda_id,npm_id,dockerhub_id,github_url,homepage,license,created_at,updated_at,last_commit_pushed_at,commit_count,recent_commit_count,fork_count,watchers_count,pr_count,open_issue_count,closed_issue_count,star_count,latest_stable_release_published_at,latest_stable_release_number,github_release_downloads,monthly_downloads,release_count,description,dependent_project_count,github_dependent_project_count,contributor_count,pypi_url,pypi_monthly_downloads,conda_url,conda_latest_release_published_at,conda_total_downloads,npm_url,npm_monthly_downloads,dockerhub_url,dockerhub_latest_release_published_at,dockerhub_stars,dockerhub_pulls,projectrank,show,category,projectrank_placing,trending +0,DeePMD-kit,deepmodeling/deepmd-kit,deepmd-kit,conda-forge/deepmd-kit,deepmd-kit,deepmodeling/deepmd-kit,https://github.com/deepmodeling/deepmd-kit,https://github.com/deepmodeling/deepmd-kit,LGPL-3.0,2017-12-12 15:23:44,2024-04-25 16:40:33.000000,2024-04-06 18:46:23,2501,49.0,464,47,1797,101.0,551.0,1364.0,2024-04-06 19:28:14,2.2.10,35219.0,16709.0,44.0,A deep learning package for many-body potential energy representation and molecular dynamics.,13.0,13.0,68,https://pypi.org/project/deepmd-kit,1848.0,https://anaconda.org/conda-forge/deepmd-kit,2024-04-07 08:33:13.101,509866.0,https://www.npmjs.com/package/deepmd-kit,6.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2024-03-04 00:17:27.208639,1.0,2249.0,29,True,others,1, +1,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2024-04-22 22:58:25.000000,2024-04-10 06:31:36,2083,15.0,168,13,794,26.0,248.0,275.0,2024-04-10 06:37:07,0.12.1,1669.0,1381.0,18.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,5.0,5.0,64,https://pypi.org/project/dpgen,756.0,https://anaconda.org/conda-forge/dpgen,2024-04-10 09:44:30.012,27367.0,,,,,,,24,True,others,1, +2,dpdata,deepmodeling/dpdata,dpdata,conda-forge/dpdata,,dptechnology/dpdata,https://github.com/deepmodeling/dpdata,https://github.com/deepmodeling/dpdata,LGPL-3.0,2019-04-12 13:24:23,2024-04-22 22:58:45.000000,2024-04-03 01:16:17,698,18.0,119,9,443,13.0,75.0,180.0,2024-04-03 01:21:35,0.2.18,,16753.0,34.0,"Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc.",115.0,115.0,57,https://pypi.org/project/dpdata,15263.0,https://anaconda.org/conda-forge/dpdata,2024-04-03 05:29:47.350,65546.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,78.0,24,True,others,1, +3,ABACUS,deepmodeling/abacus-develop,,conda-forge/abacus,,,https://github.com/deepmodeling/abacus-develop,https://github.com/deepmodeling/abacus-develop,LGPL-3.0,2021-02-01 04:04:52,2024-04-25 12:38:29.000000,2024-04-24 04:32:28,6211,180.0,114,11,2593,202.0,1189.0,138.0,2024-04-14 09:43:27,3.6.1,,3096.0,46.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,112,,,https://anaconda.org/conda-forge/abacus,2024-04-13 04:44:04.174,27872.0,,,,,,,23,True,others,1, +4,dpdispatcher,deepmodeling/dpdispatcher,dpdispatcher,conda-forge/dpdispatcher,,dptechnology/dpdispatcher,https://github.com/deepmodeling/dpdispatcher,https://github.com/deepmodeling/dpdispatcher,LGPL-3.0,2020-12-08 05:14:37,2024-04-22 22:59:22.000000,2024-04-22 22:59:21,1059,12.0,50,6,361,16.0,53.0,38.0,2024-01-21 20:29:17,0.6.4,,5333.0,44.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,47.0,47.0,44,https://pypi.org/project/dpdispatcher,2600.0,https://anaconda.org/conda-forge/dpdispatcher,2024-01-21 21:21:34.817,7400.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2024-01-21 20:33:39.770335,,93783.0,22,True,others,2, +5,reacnetgenerator,deepmodeling/reacnetgenerator,reacnetgenerator,conda-forge/reacnetgenerator,,,https://github.com/deepmodeling/reacnetgenerator,https://github.com/deepmodeling/reacnetgenerator,LGPL-3.0,2018-04-06 15:07:56,2024-04-25 17:18:13.000000,2024-04-25 00:19:18,2449,75.0,33,9,2064,6.0,118.0,58.0,2024-01-06 07:24:48,1.6.12,,7925.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,,,18,https://pypi.org/project/reacnetgenerator,1865.0,https://anaconda.org/conda-forge/reacnetgenerator,2024-01-06 10:44:38.937,284853.0,,,,,,,20,True,others,2, +6,dflow,deepmodeling/dflow,dflow,conda-forge/dflow,,dptechnology/dflow,https://github.com/deepmodeling/dflow,https://github.com/deepmodeling/dflow,LGPL-3.0,2022-01-21 08:14:36,2024-04-12 02:10:10.697305,2024-04-12 02:07:29,1966,80.0,23,1,761,13.0,21.0,50.0,2024-04-12 02:07:47,1.8.62,,123.0,100.0,Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows)..,,,22,https://pypi.org/project/dflow,,https://anaconda.org/conda-forge/dflow,,,,,https://hub.docker.com/r/dptechnology/dflow,2024-04-12 02:10:10.697305,,3322.0,18,True,others,2, +7,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2024-04-24 10:00:27.000000,2024-04-24 02:28:04,669,109.0,12,4,118,1.0,21.0,32.0,2024-04-21 14:29:24,2.0.1,,389.0,7.0,DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.,,,9,https://pypi.org/project/dptb,389.0,,,,,,,,,,17,True,others,2,1.0 +8,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2024-04-22 21:14:52.000000,2024-04-18 20:10:59,135,17.0,2,7,53,1.0,6.0,5.0,2024-04-06 04:19:45,0.4.5,,21856.0,26.0,Argument processing for the deep modeling project.,113.0,113.0,7,https://pypi.org/project/dargs,21232.0,https://anaconda.org/conda-forge/dargs,2024-04-06 06:36:32.896,22498.0,,,,,,,17,True,others,2, +9,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2024-04-23 09:49:14.000000,2024-04-21 16:13:58,1054,19.0,55,6,430,15.0,28.0,121.0,2024-03-02 04:46:26,1.3.1,,,19.0,A deep learning empowered open-source platform for reacting flow simulations.,,,23,,,,,,,,,,,,16,True,others,2, +10,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2024-04-22 21:15:23.000000,2024-04-12 21:22:45,295,18.0,4,6,425,,1.0,7.0,2023-10-13 05:16:09,1.0.0,,12817.0,4.0,A web-based GUI for user inputs.,6.0,6.0,3,https://pypi.org/project/dpgui,12817.0,,,,,,,,,,15,True,others,2, +11,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2024-04-25 02:53:18.000000,2024-01-12 00:58:20,431,,40,9,157,9.0,16.0,136.0,2023-11-09 14:32:37,1.0.0,,76.0,4.0,DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable..,,,14,,,https://anaconda.org/conda-forge/dmff,2024-01-06 07:33:02.470,230.0,,,,,,,14,True,others,2, +12,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2024-04-19 02:39:50.525172,2024-04-19 02:38:50,275,29.0,19,7,183,10.0,17.0,28.0,2023-01-28 03:43:25,0.0.7,,215.0,7.0,2nd generation of the Deep Potential GENerator.,2.0,2.0,13,https://pypi.org/project/dpgen2,122.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2024-04-19 02:39:50.525172,,2431.0,14,True,others,2, +13,JAX-FEM,deepmodeling/jax-fem,jax-fem,,,,https://github.com/deepmodeling/jax-fem,https://github.com/deepmodeling/jax-fem,GPL-3.0,2023-10-02 15:20:54,2024-04-25 06:50:52.000000,2024-04-25 06:50:25,176,22.0,28,8,3,17.0,5.0,142.0,,,,173.0,,Differentiable Finite Element Method with JAX.,,,7,https://pypi.org/project/jax-fem,173.0,,,,,,,,,,13,True,others,2,1.0 +14,rid-kit,deepmodeling/rid-kit,rid-kit,,,,https://github.com/deepmodeling/rid-kit,https://github.com/deepmodeling/rid-kit,LGPL-3.0,2021-02-02 02:44:00,2024-04-13 01:38:39.000000,2023-09-22 08:42:39,469,,21,5,21,,3.0,42.0,2023-08-29 13:51:28,0.6.2,143.0,89.0,4.0,Reinforced dynamics.,,,14,https://pypi.org/project/rid-kit,85.0,,,,,,,,,,13,True,others,2, +15,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2024-04-11 23:49:50.000000,2024-04-11 23:49:36,71,15.0,2,6,43,,,2.0,2024-04-11 23:49:50,0.0.17,,317.0,16.0,DeepModeling dargs arguments generation.,5.0,5.0,3,,,,,,https://www.npmjs.com/package/@deepmodeling/args,317.0,,,,,12,True,others,3, +16,deepmodeling_sphinx,deepmodeling/deepmodeling_sphinx,deepmodeling_sphinx,,,,https://github.com/deepmodeling/deepmodeling_sphinx,https://github.com/deepmodeling/deepmodeling_sphinx,LGPL-3.0,2022-03-04 00:19:06,2024-04-22 21:14:50.000000,2024-04-18 20:20:20,62,7.0,6,5,54,,,2.0,2023-12-17 21:15:58,0.2.5,,2490.0,18.0,Sphinx extension for DeepModeling projects.,,,7,https://pypi.org/project/deepmodeling_sphinx,2490.0,,,,,,,,,,12,True,others,3, +17,APEX,deepmodeling/APEX,apex-flow,,,,https://github.com/deepmodeling/APEX,https://github.com/deepmodeling/APEX,LGPL-3.0,2023-04-20 06:13:42,2024-04-24 08:51:50.000000,2024-04-07 08:18:45,301,6.0,14,7,61,,4.0,13.0,2023-09-25 09:25:46,1.0.1,,69.0,3.0,APEX: Alloy Properties EXplorer using simulations.,,,6,https://pypi.org/project/apex-flow,69.0,,,,,,,,,,11,True,others,3,-1.0 +18,fealpy,deepmodeling/fealpy,fealpy,,,,https://github.com/deepmodeling/fealpy,https://github.com/deepmodeling/fealpy,,2023-04-10 03:58:57,2024-04-24 03:09:27.000000,2024-04-24 01:36:31,6125,274.0,2,1,1,,,2.0,,,,155.0,,Finite Element Analysis Library in Python.,,,57,https://pypi.org/project/fealpy,155.0,,,,,,,,,,11,True,others,3,2.0 +19,DeePKS-kit,deepmodeling/deepks-kit,,,,,https://github.com/deepmodeling/deepks-kit,https://github.com/deepmodeling/deepks-kit,LGPL-3.0,2020-07-29 03:27:50,2024-04-13 03:44:40.000000,2024-04-13 03:44:40,384,4.0,32,14,42,3.0,13.0,97.0,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7,,,,,,,,,,,,10,True,others,3, +20,dpti,deepmodeling/dpti,dpti,,,,https://github.com/deepmodeling/dpti,https://github.com/deepmodeling/dpti,LGPL-3.0,2021-04-04 13:57:37,2024-04-22 21:15:17.000000,2024-04-13 06:51:36,394,12.0,20,7,58,7.0,,18.0,,,,22.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,,,16,https://pypi.org/project/dpti,22.0,,,,,,,,,,10,True,others,3, +21,Uni-Fold,deepmodeling/Uni-Fold,,,,dptechnology/unifold,https://github.com/deepmodeling/Uni-Fold,https://github.com/deepmodeling/Uni-Fold,Apache-2.0,2021-12-07 14:40:37,2024-04-11 02:15:21.000000,2022-08-18 15:27:32,29,,18,5,2,,1.0,90.0,,,,21.0,,,,,3,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,607.0,8,True,others,3, +22,fpop,deepmodeling/fpop,fpop,,,,https://github.com/deepmodeling/fpop,https://github.com/deepmodeling/fpop,LGPL-3.0,2023-02-10 03:16:47,2024-04-11 02:10:46.000000,2024-02-28 06:09:59,38,1.0,7,9,21,3.0,,1.0,,,,2190.0,,,5.0,5.0,3,https://pypi.org/project/fpop,2190.0,,,,,,,,,,8,True,others,3, +23,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2024-03-29 10:49:08.000000,2024-03-29 10:48:54,106,14.0,18,11,34,,2.0,77.0,,,,,,DeepModeling community content.,,,15,,,,,,,,,,,,7,True,others,3, +24,tbplas,deepmodeling/tbplas,,,,,https://github.com/deepmodeling/tbplas,https://github.com/deepmodeling/tbplas,,2024-02-29 03:21:24,2024-04-11 02:16:51.000000,2024-01-17 13:25:05,662,,3,9,2,1.0,,4.0,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10,,,,,,,,,,,,7,True,others,3, +25,docs,deepmodeling/docs,,,,,https://github.com/deepmodeling/docs,https://github.com/deepmodeling/docs,LGPL-3.0,2021-07-05 00:32:29,2024-04-11 04:19:01.000000,2024-04-11 04:19:01,27,3.0,7,5,22,,,3.0,,,,,,The home page of DeepModeling documentation.,,,8,,,,,,,,,,,,7,True,others,3, +26,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2024-04-18 22:29:11.000000,2024-04-18 22:29:11,164,7.0,7,6,91,,,1.0,,,,,,DeepModeling Blog.,,,7,,,,,,,,,,,,7,True,others,3,1.0 +27,AI4Science101,deepmodeling/AI4Science101,,,,,https://github.com/deepmodeling/AI4Science101,https://github.com/deepmodeling/AI4Science101,,2022-06-19 02:26:48,2024-04-11 02:15:55.000000,2022-09-04 02:06:18,139,,13,9,29,,1.0,82.0,,,,,,AI for Science.,,,5,,,,,,,,,,,,6,True,others,3, +28,tutorials,deepmodeling/tutorials,,,,,https://github.com/deepmodeling/tutorials,https://github.com/deepmodeling/tutorials,,2022-03-07 06:19:19,2024-04-11 02:15:37.000000,2022-09-26 07:49:48,136,,21,5,62,,2.0,12.0,,,,,,Tutorials for DeepModeling projects.,,,10,,,,,,,,,,,,6,True,others,3, +29,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2024-04-24 08:48:26.000000,2023-12-06 03:06:55,469,,8,8,210,5.0,1.0,10.0,,,,,,,,,8,,,,,,,,,,,,6,True,others,3, +30,DeepH-pack,deepmodeling/DeepH-pack,,,,,https://github.com/deepmodeling/DeepH-pack,https://github.com/deepmodeling/DeepH-pack,LGPL-3.0,2022-07-19 08:07:24,2024-04-11 02:16:01.000000,2023-12-28 12:48:09,56,,6,2,2,4.0,2.0,11.0,,,,,,Deep neural networks for density functional theory Hamiltonian.,,,6,,,,,,,,,,,,5,True,others,3, +31,tutorials-cn,deepmodeling/tutorials-cn,,,,,https://github.com/deepmodeling/tutorials-cn,https://github.com/deepmodeling/tutorials-cn,LGPL-2.1,2022-03-30 07:39:32,2024-04-11 02:15:41.000000,2022-12-29 11:58:55,9,,7,5,12,,,3.0,,,,,,,,,4,,,,,,,,,,,,5,True,others,3, +32,ADMP,deepmodeling/ADMP,,,,,https://github.com/deepmodeling/ADMP,https://github.com/deepmodeling/ADMP,,2021-12-26 07:22:47,2024-04-11 02:15:25.000000,2022-02-15 02:13:59,120,,2,1,6,,,2.0,,,,,,Automatic Differentiation Multipole Moment Molecular Forcefield.,,,7,,,,,,,,,,,,3,True,others,3, +33,LibRI,deepmodeling/LibRI,,,,,https://github.com/deepmodeling/LibRI,https://github.com/deepmodeling/LibRI,GPL-3.0,2023-04-19 02:10:20,2024-04-11 02:16:14.000000,2023-04-10 15:53:42,80,,1,2,1,2.0,1.0,6.0,,,,,,,,,2,,,,,,,,,,,,2,True,others,3, +34,openfinite,deepmodeling/openfinite,,,,,https://github.com/deepmodeling/openfinite,https://github.com/deepmodeling/openfinite,LGPL-3.0,2021-10-10 08:56:48,2024-04-11 02:15:14.000000,2021-10-06 08:13:39,13,,1,1,1,,,1.0,,,,,,,,,2,,,,,,,,,,,,1,True,others,3, +35,dflow-op-cutter,deepmodeling/dflow-op-cutter,,,,,https://github.com/deepmodeling/dflow-op-cutter,https://github.com/deepmodeling/dflow-op-cutter,,2022-06-24 01:31:42,2024-04-11 02:15:58.000000,2022-07-06 09:54:08,4,,1,4,1,,1.0,,,,,,,,,,2,,,,,,,,,,,,1,True,others,3, diff --git a/latest-changes.md b/latest-changes.md index 3cefc6f..4ca5a90 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,15 +2,14 @@ _Projects that have a higher project-quality score compared to the last update. There might be a variety of reasons, such as increased downloads or code activity._ -- DeePTB (🥈16 · ⭐ 32 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 -- DPGEN2 (🥈14 · ⭐ 28 · 📈) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- APEX (🥈12 · ⭐ 13 · 📈) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 -- args (🥈12 · ⭐ 2 · 📈) - DeepModeling dargs arguments generation. LGPL-3.0 -- dpti (🥉10 · ⭐ 18 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 +- DeePTB (🥈17 · ⭐ 32 · 📈) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +- JAX-FEM (🥈13 · ⭐ 140 · 🐣) - Differentiable Finite Element Method with JAX. GPL-3.0 +- fealpy (🥉11 · ⭐ 2 · 📈) - Finite Element Analysis Library in Python. Unlicensed +- Blog (🥉7 · ⭐ 1 · 📈) - DeepModeling Blog. LGPL-3.0 ## 📉 Trending Down _Projects that have a lower project-quality score compared to the last update. There might be a variety of reasons such as decreased downloads or code activity._ -- Blog (🥉6 · ⭐ 1 · 📉) - DeepModeling Blog. LGPL-3.0 +- APEX (🥉11 · ⭐ 13 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0