diff --git a/README.md b/README.md index 9cdecc3..179ebc0 100644 --- a/README.md +++ b/README.md @@ -15,7 +15,7 @@

-This curated list contains 38 awesome open-source projects with a total of 4.5K 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 38 awesome open-source projects with a total of 4.6K 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). @@ -46,16 +46,16 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K
DeePMD-kit (🥇29 · ⭐ 1.8K) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 84 · 🔀 550 · 📥 64K · 📦 40 · 📋 940 - 8% open · ⏱️ 25.11.2025): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 84 · 🔀 560 · 📥 64K · 📦 41 · 📋 940 - 9% open · ⏱️ 04.12.2025): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 8.7K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 6.7K / month): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 2.3M · ⏱️ 05.11.2025): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 2.4M · ⏱️ 05.11.2025): ``` conda install -c conda-forge deepmd-kit ``` @@ -70,28 +70,28 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K
DP-GEN (🥇24 · ⭐ 370) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen) (👨‍💻 73 · 🔀 180 · 📥 2K · 📦 8 · 📋 330 - 10% open · ⏱️ 25.11.2025): +- [GitHub](https://github.com/deepmodeling/dpgen) (👨‍💻 73 · 🔀 180 · 📥 2K · 📦 8 · 📋 330 - 10% open · ⏱️ 02.12.2025): ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 6K / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 3.9K / month): ``` pip install dpgen ``` -- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 46K · ⏱️ 07.08.2025): +- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 47K · ⏱️ 07.08.2025): ``` conda install -c conda-forge dpgen ```
dpdata (🥇24 · ⭐ 240) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 67 · 🔀 140 · 📦 150 · 📋 130 - 20% open · ⏱️ 25.11.2025): +- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 67 · 🔀 140 · 📦 150 · 📋 130 - 20% open · ⏱️ 02.12.2025): ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 45K / month): +- [PyPi](https://pypi.org/project/dpdata) (📥 43K / month): ``` pip install dpdata ``` @@ -99,19 +99,19 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K ``` conda install -c conda-forge dpdata ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpdata) (📥 660 · ⏱️ 02.06.2023): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpdata) (📥 680 · ⏱️ 02.06.2023): ``` docker pull dptechnology/dpdata ```
ABACUS (🥇24 · ⭐ 230) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 140 · 🔀 140 · 📋 2.4K - 7% open · ⏱️ 26.11.2025): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 140 · 🔀 150 · 📋 2.4K - 7% open · ⏱️ 04.12.2025): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 530K · ⏱️ 04.11.2025): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 540K · ⏱️ 30.11.2025): ``` conda install -c conda-forge abacus ``` @@ -123,7 +123,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 21K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 17K / month): ``` pip install dpdispatcher ``` @@ -136,58 +136,50 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K docker pull dptechnology/dpdispatcher ```
-
dflow (🥈19 · ⭐ 74) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 +
reacnetgenerator (🥈18 · ⭐ 95) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 23 · 🔀 29 · 📋 36 - 36% open · ⏱️ 23.09.2025): +- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 19 · 🔀 41 · 📦 3 · 📋 130 - 5% open · ⏱️ 02.10.2025): ``` - git clone https://github.com/deepmodeling/dflow - ``` -- [PyPi](https://pypi.org/project/dflow): - ``` - pip install dflow + git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [Conda](https://anaconda.org/conda-forge/dflow): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 1.2K / month): ``` - conda install -c conda-forge dflow + pip install reacnetgenerator ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dflow) (📥 16K · ⏱️ 23.09.2025): +- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 700K · ⏱️ 11.11.2025): ``` - docker pull dptechnology/dflow + conda install -c conda-forge reacnetgenerator ```
-
reacnetgenerator (🥈18 · ⭐ 95 · 📉) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 +
dflow (🥈18 · ⭐ 75 · 📉) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 19 · 🔀 41 · 📦 3 · 📋 130 - 5% open · ⏱️ 02.10.2025): +- [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 23 · 🔀 29 · 📋 36 - 36% open · ⏱️ 23.09.2025): ``` - git clone https://github.com/deepmodeling/reacnetgenerator + git clone https://github.com/deepmodeling/dflow ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 1.1K / month): +- [PyPi](https://pypi.org/project/dflow): ``` - pip install reacnetgenerator + pip install dflow ``` -- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 690K · ⏱️ 11.11.2025): +- [Conda](https://anaconda.org/conda-forge/dflow): ``` - conda install -c conda-forge reacnetgenerator + conda install -c conda-forge dflow ``` -
-
DeepFlame (🥈17 · ⭐ 190) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 - -- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 29 · 🔀 72 · 📋 60 - 43% open · ⏱️ 23.07.2025): - +- [Docker Hub](https://hub.docker.com/r/dptechnology/dflow) (📥 16K · ⏱️ 23.09.2025): ``` - git clone https://github.com/deepmodeling/deepflame-dev + docker pull dptechnology/dflow ```
-
dargs (🥈17 · ⭐ 6 · 📈) - Argument processing for the deep modeling project. LGPL-3.0 +
dargs (🥈17 · ⭐ 6) - Argument processing for the deep modeling project. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 150 · 📋 9 - 22% open · ⏱️ 18.08.2025): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 58K / month): +- [PyPi](https://pypi.org/project/dargs) (📥 55K / month): ``` pip install dargs ``` @@ -198,40 +190,48 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K
JAX-FEM (🥈16 · ⭐ 540) - Differentiable Finite Element Method with JAX. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 17 · 🔀 86 · 📦 3 · 📋 68 - 33% open · ⏱️ 13.11.2025): +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 17 · 🔀 88 · 📦 3 · 📋 68 - 33% open · ⏱️ 13.11.2025): ``` git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 750 / month): +- [PyPi](https://pypi.org/project/jax-fem) (📥 790 / month): ``` pip install jax-fem ```
-
DeePTB (🥈16 · ⭐ 91 · 📈) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 +
DeepFlame (🥈16 · ⭐ 190 · 📉) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 12 · 🔀 24 · 📦 4 · 📋 56 - 35% open · ⏱️ 26.11.2025): +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 29 · 🔀 72 · 📋 60 - 43% open · ⏱️ 23.07.2025): + + ``` + git clone https://github.com/deepmodeling/deepflame-dev + ``` +
+
DeePTB (🥈16 · ⭐ 91) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 12 · 🔀 24 · 📦 4 · 📋 56 - 35% open · ⏱️ 30.11.2025): ``` git clone https://github.com/deepmodeling/DeePTB ``` -- [PyPi](https://pypi.org/project/dptb) (📥 270 / month): +- [PyPi](https://pypi.org/project/dptb) (📥 210 / month): ``` pip install dptb ```
DPGEN2 (🥈16 · ⭐ 40) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 18 · 🔀 35 · 📦 6 · 📋 45 - 37% open · ⏱️ 25.11.2025): +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 19 · 🔀 35 · 📦 6 · 📋 45 - 37% open · ⏱️ 02.12.2025): ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 160 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 140 / month): ``` pip install dpgen2 ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 4.2K · ⏱️ 25.11.2025): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 4.2K · ⏱️ 02.12.2025): ``` docker pull dptechnology/dpgen2 ``` @@ -255,48 +255,48 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K ``` git clone https://github.com/deepmodeling/APEX ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 240 / month): +- [PyPi](https://pypi.org/project/apex-flow) (📥 250 / month): ``` pip install apex-flow ```
-
DP-GUI (🥈14 · ⭐ 8 · 📈) - A web-based GUI for user inputs. LGPL-3.0 +
DP-GUI (🥈14 · ⭐ 8) - A web-based GUI for user inputs. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 4 · 🔀 5 · 📦 13 · ⏱️ 26.08.2025): ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 15K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 18K / month): ``` pip install dpgui ```
-
deepmodeling_sphinx (🥉12 · ⭐ 3) - Sphinx extension for DeepModeling projects. LGPL-3.0 +
rid-kit (🥉12 · ⭐ 51 · 💤) - Reinforced dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 8 · 🔀 6 · ⏱️ 12.11.2025): +- [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 24 · 📥 150 · 📦 2 · 📋 5 - 40% open · ⏱️ 31.03.2025): ``` - git clone https://github.com/deepmodeling/deepmodeling_sphinx + git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 1.4K / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 42 / month): ``` - pip install deepmodeling_sphinx + pip install rid-kit ```
-
rid-kit (🥉11 · ⭐ 50 · 💤) - Reinforced dynamics. LGPL-3.0 +
deepmodeling_sphinx (🥉12 · ⭐ 3) - Sphinx extension for DeepModeling projects. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 24 · 📥 150 · 📦 2 · 📋 5 - 40% open · ⏱️ 31.03.2025): +- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 8 · 🔀 6 · ⏱️ 12.11.2025): ``` - git clone https://github.com/deepmodeling/rid-kit + git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 17 / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 1.6K / month): ``` - pip install rid-kit + pip install deepmodeling_sphinx ```
-
GPUMD (🥉11 · ⭐ 9 · 📉) - Graphics Processing Units Molecular Dynamics. GPL-3.0 +
GPUMD (🥉11 · ⭐ 9) - Graphics Processing Units Molecular Dynamics. GPL-3.0 - [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 53 · ⏱️ 07.10.2025): @@ -311,7 +311,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 4.4K / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 3.5K / month): ``` pip install fealpy ``` @@ -323,7 +323,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K ``` git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/dpti) (📥 50 / month): +- [PyPi](https://pypi.org/project/dpti) (📥 40 / month): ``` pip install dpti ``` @@ -335,7 +335,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K ``` git clone https://github.com/deepmodeling/fpop ``` -- [PyPi](https://pypi.org/project/fpop) (📥 2.2K / month): +- [PyPi](https://pypi.org/project/fpop) (📥 2K / month): ``` pip install fpop ``` @@ -350,25 +350,25 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K
AIS-Square (🥉9 · ⭐ 15) - LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 8 · 📋 6 - 83% open · ⏱️ 17.11.2025): +- [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 8 · 📋 6 - 83% open · ⏱️ 03.12.2025): ``` git clone https://github.com/deepmodeling/AIS-Square ```
-
args (🥉9 · ⭐ 2 · 📉) - DeepModeling dargs arguments generation. LGPL-3.0 +
args (🥉9 · ⭐ 2) - DeepModeling dargs arguments generation. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/args) (👨‍💻 3 · 🔀 2 · 📦 5 · ⏱️ 12.08.2025): ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 45 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 54 / month): ``` npm install @deepmodeling/args ```
-
community (🥉8 · ⭐ 88) - DeepModeling community content. Unlicensed +
community (🥉8 · ⭐ 89) - DeepModeling community content. Unlicensed - [GitHub](https://github.com/deepmodeling/community) (👨‍💻 19 · 🔀 23 · ⏱️ 03.11.2025): @@ -420,7 +420,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.5K git clone https://github.com/deepmodeling/docs ```
-
AI4Science101 (🥉5 · ⭐ 98 · 💤) - AI for Science. Unlicensed +
AI4Science101 (🥉5 · ⭐ 99 · 💤) - AI for Science. Unlicensed - [GitHub](https://github.com/deepmodeling/AI4Science101) (👨‍💻 5 · 🔀 15 · ⏱️ 04.09.2022): diff --git a/history/2025-12-04_changes.md b/history/2025-12-04_changes.md new file mode 100644 index 0000000..9b933d9 --- /dev/null +++ b/history/2025-12-04_changes.md @@ -0,0 +1,13 @@ +## 📈 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._ + +- rid-kit (🥉12 · ⭐ 51 · 💤) - Reinforced dynamics. 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._ + +- dflow (🥈18 · ⭐ 75 · 📉) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 +- DeepFlame (🥈16 · ⭐ 190 · 📉) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 + diff --git a/history/2025-12-04_projects.csv b/history/2025-12-04_projects.csv new file mode 100644 index 0000000..9e85738 --- /dev/null +++ b/history/2025-12-04_projects.csv @@ -0,0 +1,39 @@ +,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 15:23:44,2025-12-04 16:26:10.000000,2025-12-04 09:22:40,3456,66.0,555.0,46.0,2593.0,85.0,857.0,1806,2025-09-30 18:02:36,3.1.1,63875.0,49646.0,59.0,A deep learning package for many-body potential energy representation and molecular dynamics.,41.0,41.0,84.0,https://pypi.org/project/deepmd-kit,6673.0,https://anaconda.org/conda-forge/deepmd-kit,2025-11-05 14:45:59.725,2354430.0,https://www.npmjs.com/package/deepmd-kit,6.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2025-11-12 14:59:25.522676,1.0,4795.0,29,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 11:43:56,2025-12-02 00:41:58.000000,2025-12-02 00:41:56,2226,19.0,176.0,10.0,939.0,33.0,297.0,371,2025-08-07 07:42:12,0.13.2,2033.0,4656.0,21.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,8.0,8.0,73.0,https://pypi.org/project/dpgen,3922.0,https://anaconda.org/conda-forge/dpgen,2025-08-07 18:05:24.933,46720.0,,,,,,,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 13:24:23,2025-12-02 00:42:08.000000,2025-12-02 00:42:07,881,22.0,144.0,5.0,636.0,27.0,102.0,236,2025-10-21 07:55:49,1.0.0,,44340.0,42.0,A Python package for manipulating atomistic data of software in computational science.,148.0,148.0,67.0,https://pypi.org/project/dpdata,42546.0,https://anaconda.org/conda-forge/dpdata,2025-10-21 10:00:11.600,114344.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,678.0,24,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 04:04:52,2025-12-04 14:38:33.000000,2025-12-04 14:25:14,7532,140.0,146.0,9.0,4180.0,186.0,2242.0,228,2025-11-24 04:44:08,3.9.0.19,,18580.0,84.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,135.0,,,https://anaconda.org/conda-forge/abacus,2025-11-30 07:59:33.008,538830.0,,,,,,,24,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 05:14:37,2025-12-01 20:54:58.000000,2025-11-24 06:44:29,1131,11.0,56.0,4.0,439.0,18.0,77.0,53,2025-11-11 01:28:31,1.0.0,,20159.0,53.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,69.0,69.0,48.0,https://pypi.org/project/dpdispatcher,16924.0,https://anaconda.org/conda-forge/dpdispatcher,2025-11-11 15:58:45.631,36151.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2025-11-11 01:33:15.628472,,138592.0,24,True,others,1, +5,reacnetgenerator,deepmodeling/reacnetgenerator,reacnetgenerator,conda-forge/reacnetgenerator,,,https://github.com/deepmodeling/reacnetgenerator,https://github.com/deepmodeling/reacnetgenerator,LGPL-3.0,2018-04-06 15:07:56,2025-12-01 20:55:07.000000,2025-10-02 19:21:25,2544,2.0,41.0,5.0,2251.0,7.0,124.0,95,2025-01-05 07:30:15,1.6.15,,11578.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,3.0,3.0,19.0,https://pypi.org/project/reacnetgenerator,1186.0,https://anaconda.org/conda-forge/reacnetgenerator,2025-11-11 16:14:11.843,696264.0,,,,,,,18,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 08:14:36,2025-09-23 12:38:05.455745,2025-09-23 12:35:28,2273,16.0,29.0,,912.0,13.0,23.0,75,2025-09-23 12:35:55,1.8.132,,341.0,100.0,Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows)..,,,23.0,https://pypi.org/project/dflow,,https://anaconda.org/conda-forge/dflow,,,,,https://hub.docker.com/r/dptechnology/dflow,2025-09-23 12:38:05.455745,,16044.0,18,True,others,2,-1.0 +7,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2025-12-01 20:54:54.000000,2025-08-18 11:52:31,164,,3.0,4.0,84.0,2.0,7.0,6,2024-11-21 03:25:26,0.4.10,,55534.0,31.0,Argument processing for the deep modeling project.,151.0,151.0,7.0,https://pypi.org/project/dargs,54532.0,https://anaconda.org/conda-forge/dargs,2025-04-22 14:57:50.542,56122.0,,,,,,,17,True,others,2, +8,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 15:20:54,2025-11-13 10:57:46.000000,2025-11-13 10:56:33,272,18.0,88.0,12.0,13.0,23.0,45.0,542,,,,787.0,,Differentiable Finite Element Method with JAX.,3.0,3.0,17.0,https://pypi.org/project/jax-fem,787.0,,,,,,,,,,16,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 10:25:12,2025-10-11 12:17:42.000000,2025-07-23 10:47:26,1176,,72.0,6.0,509.0,26.0,34.0,194,2025-06-26 04:29:15,1.6.0,,,22.0,A deep learning empowered open-source platform for reacting flow simulations.,,,29.0,,,,,,,,,,,,16,True,others,2,-1.0 +10,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2025-11-30 02:49:56.000000,2025-11-30 02:48:58,810,10.0,24.0,2.0,226.0,20.0,36.0,91,2025-05-07 14:02:40,2.2.0,,210.0,12.0,DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy.,4.0,4.0,12.0,https://pypi.org/project/dptb,210.0,,,,,,,,,,16,True,others,2, +11,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2025-12-02 00:42:11.214113,2025-12-02 00:40:35,348,6.0,35.0,5.0,270.0,17.0,28.0,40,2023-01-28 03:43:25,0.0.7,,226.0,7.0,2nd generation of the Deep Potential GENerator.,6.0,6.0,19.0,https://pypi.org/project/dpgen2,135.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2025-12-02 00:42:11.214113,,4212.0,16,True,others,2, +12,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2025-12-02 23:27:00.000000,2025-08-06 00:16:18,438,,47.0,8.0,180.0,8.0,20.0,181,2023-11-09 14:32:37,1.0.0,,117.0,4.0,DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable..,,,17.0,,,https://anaconda.org/conda-forge/dmff,2025-04-22 14:58:55.028,2703.0,,,,,,,14,True,others,2, +13,APEX,deepmodeling/APEX,apex-flow,,,,https://github.com/deepmodeling/APEX,https://github.com/deepmodeling/APEX,LGPL-3.0,2023-04-20 06:13:42,2025-05-07 07:41:26.000000,2025-04-10 13:16:14,621,,22.0,6.0,88.0,1.0,9.0,40,2024-05-06 10:01:52,1.2.0,,247.0,4.0,APEX: Alloy Properties EXplorer using simulations.,4.0,4.0,7.0,https://pypi.org/project/apex-flow,247.0,,,,,,,,,,14,True,others,2, +14,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2025-12-01 20:55:17.000000,2025-08-26 11:26:26,326,,5.0,5.0,554.0,,1.0,8,2024-11-17 07:05:49,1.0.1.post0,,18157.0,5.0,A web-based GUI for user inputs.,13.0,13.0,4.0,https://pypi.org/project/dpgui,18157.0,,,,,,,,,,14,True,others,2, +15,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 02:44:00,2025-03-31 04:23:22.000000,2025-03-31 04:21:54,477,,24.0,3.0,21.0,2.0,3.0,51,2024-05-14 03:25:35,0.6.4,148.0,44.0,5.0,Reinforced dynamics.,2.0,2.0,14.0,https://pypi.org/project/rid-kit,42.0,,,,,,,,,,12,True,others,3,1.0 +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 00:19:06,2025-12-01 20:54:59.000000,2025-11-12 10:16:02,81,3.0,6.0,4.0,75.0,,1.0,3,2025-11-12 10:16:41,0.3.2,,1555.0,26.0,Sphinx extension for DeepModeling projects.,,,8.0,https://pypi.org/project/deepmodeling_sphinx,1555.0,,,,,,,,,,12,True,others,3, +17,GPUMD,deepmodeling/GPUMD,,,,,https://github.com/deepmodeling/GPUMD,https://github.com/deepmodeling/GPUMD,GPL-3.0,2024-06-18 05:40:21,2025-10-07 09:43:49.000000,2025-10-07 09:15:51,5870,160.0,,,,,,9,,,,,,Graphics Processing Units Molecular Dynamics.,,,53.0,,,,,,,,,,,,11,True,others,3, +18,fealpy,deepmodeling/fealpy,fealpy,,,,https://github.com/deepmodeling/fealpy,https://github.com/deepmodeling/fealpy,,2023-04-10 03:58:57,2025-05-09 01:36:48.000000,2025-04-28 09:12:41,9611,,2.0,,1.0,,,6,,,,3520.0,,Finite Element Analysis Library in Python.,,,69.0,https://pypi.org/project/fealpy,3520.0,,,,,,,,,,11,True,others,3, +19,dpti,deepmodeling/dpti,dpti,,,,https://github.com/deepmodeling/dpti,https://github.com/deepmodeling/dpti,LGPL-3.0,2021-04-04 13:57:37,2025-12-01 20:55:41.000000,2025-03-15 19:50:12,432,,21.0,5.0,85.0,9.0,1.0,30,,,,40.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,2.0,2.0,17.0,https://pypi.org/project/dpti,40.0,,,,,,,,,,10,True,others,3, +20,fpop,deepmodeling/fpop,fpop,,,,https://github.com/deepmodeling/fpop,https://github.com/deepmodeling/fpop,LGPL-3.0,2023-02-10 03:16:47,2024-07-01 09:11:36.000000,2024-07-01 09:11:36,42,,12.0,8.0,25.0,4.0,,3,,,,2028.0,,,15.0,15.0,4.0,https://pypi.org/project/fpop,2028.0,,,,,,,,,,10,True,others,3, +21,DeePKS-kit,deepmodeling/deepks-kit,,,,,https://github.com/deepmodeling/deepks-kit,https://github.com/deepmodeling/deepks-kit,LGPL-3.0,2020-07-29 03:27:50,2025-04-28 21:22:59.000000,2025-04-28 21:22:58,385,,37.0,12.0,47.0,14.0,17.0,117,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7.0,,,,,,,,,,,,9,True,others,3, +22,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2025-12-03 03:41:20.000000,2025-12-03 03:41:20,1222,78.0,8.0,7.0,211.0,5.0,1.0,15,,,,,,,,,8.0,,,,,,,,,,,,9,True,others,3, +23,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2025-11-24 15:51:06.000000,2025-08-12 05:43:10,86,,2.0,4.0,68.0,,,2,2025-03-06 02:44:56,0.1.1,,54.0,18.0,DeepModeling dargs arguments generation.,5.0,5.0,3.0,,,,,,https://www.npmjs.com/package/@deepmodeling/args,54.0,,,,,9,True,others,3, +24,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2025-11-03 07:07:19.000000,2025-11-03 07:07:19,171,6.0,23.0,9.0,54.0,,2.0,89,,,,,,DeepModeling community content.,,,19.0,,,,,,,,,,,,8,True,others,3, +25,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2025-11-26 08:23:54.000000,2025-11-26 08:23:52,379,9.0,9.0,5.0,332.0,,,3,,,,,,DeepModeling Blog.,,,11.0,,,,,,,,,,,,8,True,others,3, +26,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,,19.0,4.0,2.0,,1.0,92,,,,24.0,,,,,3.0,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,1199.0,7,True,others,3, +27,tutorials,deepmodeling/tutorials,,,,,https://github.com/deepmodeling/tutorials,https://github.com/deepmodeling/tutorials,,2022-03-07 06:19:19,2025-04-03 06:16:39.000000,2025-04-03 06:16:39,146,,23.0,4.0,67.0,1.0,3.0,15,,,,,,Tutorials for DeepModeling projects.,,,12.0,,,,,,,,,,,,6,True,others,3, +28,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,,6.0,8.0,2.0,3.0,,14,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10.0,,,,,,,,,,,,6,True,others,3, +29,docs,deepmodeling/docs,,,,,https://github.com/deepmodeling/docs,https://github.com/deepmodeling/docs,LGPL-3.0,2021-07-05 00:32:29,2024-10-28 21:42:38.000000,2024-10-28 21:42:38,28,,7.0,4.0,24.0,,,3,,,,,,The home page of DeepModeling documentation.,,,8.0,,,,,,,,,,,,6,True,others,3, +30,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,,15.0,8.0,29.0,,1.0,99,,,,,,AI for Science.,,,5.0,,,,,,,,,,,,5,True,others,3, +31,DeePDih,deepmodeling/DeePDih,,,,,https://github.com/deepmodeling/DeePDih,https://github.com/deepmodeling/DeePDih,MIT,2024-03-03 13:22:19,2025-08-05 23:30:28.000000,2025-08-05 23:30:28,63,,3.0,2.0,,,,6,2024-12-21 09:53:32,dpa-2-gfn2-xtb-tblite,6.0,0.0,1.0,Deep Potential driven molecular dihedral scan toolkit.,,,,,,,,,,,,,,,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,,3.0,,6.0,,,3,,,,,,Automatic Differentiation Multipole Moment Molecular Forcefield.,,,7.0,,,,,,,,,,,,5,True,others,3, +33,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,,6.0,1.0,2.0,4.0,2.0,12,,,,,,Deep neural networks for density functional theory Hamiltonian.,,,6.0,,,,,,,,,,,,4,True,others,3, +34,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,,8.0,4.0,13.0,,,6,,,,,,,,,4.0,,,,,,,,,,,,4,True,others,3, +35,LibRI,deepmodeling/LibRI,,,,,https://github.com/deepmodeling/LibRI,https://github.com/deepmodeling/LibRI,GPL-3.0,2023-04-19 02:10:20,2025-02-18 05:21:27.000000,2025-01-10 16:30:29,127,,1.0,1.0,1.0,2.0,1.0,6,,,,,,,,,3.0,,,,,,,,,,,,2,True,others,3, +36,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,,2.0,,1.0,,,1,,,,,,,,,2.0,,,,,,,,,,,,1,True,others,3, +37,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,,2.0,3.0,1.0,,1.0,1,,,,,,,,,2.0,,,,,,,,,,,,-1,True,others,3, diff --git a/latest-changes.md b/latest-changes.md index 8e82371..9b933d9 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,17 +2,12 @@ _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._ -- dargs (🥈17 · ⭐ 6 · 📈) - Argument processing for the deep modeling project. LGPL-3.0 -- DeePTB (🥈16 · ⭐ 91 · 📈) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 -- DP-GUI (🥈14 · ⭐ 8 · 📈) - A web-based GUI for user inputs. LGPL-3.0 -- fpop (🥉10 · ⭐ 3 · 💤) - LGPL-3.0 +- rid-kit (🥉12 · ⭐ 51 · 💤) - Reinforced dynamics. 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._ -- reacnetgenerator (🥈18 · ⭐ 95 · 📉) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- rid-kit (🥉11 · ⭐ 50 · 💤) - Reinforced dynamics. LGPL-3.0 -- GPUMD (🥉11 · ⭐ 9 · 📉) - Graphics Processing Units Molecular Dynamics. GPL-3.0 -- args (🥉9 · ⭐ 2 · 📉) - DeepModeling dargs arguments generation. LGPL-3.0 +- dflow (🥈18 · ⭐ 75 · 📉) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 +- DeepFlame (🥈16 · ⭐ 190 · 📉) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0