diff --git a/README.md b/README.md index 8ecd9c4..faa84f4 100644 --- a/README.md +++ b/README.md @@ -15,7 +15,7 @@

-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! +This curated list contains 36 awesome open-source projects with a total of 3.2K 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 3.1K
DeePMD-kit (🥇28 · ⭐ 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 · 🔀 470 · 📥 37K · 📦 14 · 📋 690 - 11% open · ⏱️ 06.04.2024): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 68 · 🔀 470 · 📥 37K · 📦 14 · 📋 700 - 10% open · ⏱️ 06.04.2024): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 1.1K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 1.3K / month): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 600K · ⏱️ 27.05.2024): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 620K · ⏱️ 05.06.2024): ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 15 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 8 / month): ``` npm install deepmd-kit ``` @@ -68,18 +68,18 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K docker pull deepmodeling/deepmd-kit ```
-
dpdata (🥇24 · ⭐ 180) - Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc. LGPL-3.0 +
dpdata (🥇24 · ⭐ 190) - Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 57 · 🔀 120 · 📦 120 · 📋 91 - 17% open · ⏱️ 03.04.2024): +- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 60 · 🔀 120 · 📦 120 · 📋 92 - 18% open · ⏱️ 06.06.2024): ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 30K / month): +- [PyPi](https://pypi.org/project/dpdata) (📥 33K / month): ``` pip install dpdata ``` -- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 68K · ⏱️ 03.04.2024): +- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 68K · ⏱️ 06.06.2024): ``` conda install -c conda-forge dpdata ``` @@ -90,12 +90,12 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K
ABACUS (🥇24 · ⭐ 150) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 120 · 📋 1.5K - 15% open · ⏱️ 30.05.2024): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 120 · 🔀 120 · 📋 1.5K - 14% open · ⏱️ 04.06.2024): ``` git clone https://github.com/deepmodeling/abacus-develop ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 46K · ⏱️ 27.05.2024): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 51K · ⏱️ 27.05.2024): ``` conda install -c conda-forge abacus ``` @@ -107,27 +107,27 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 410 / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 390 / month): ``` pip install dpgen ``` -- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 28K · ⏱️ 10.04.2024): +- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 29K · ⏱️ 10.04.2024): ``` conda install -c conda-forge dpgen ```
dpdispatcher (🥈22 · ⭐ 40) - 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) (👨‍💻 46 · 🔀 53 · 📦 47 · 📋 70 - 21% open · ⏱️ 29.05.2024): +- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 46 · 🔀 53 · 📦 47 · 📋 71 - 22% open · ⏱️ 29.05.2024): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.4K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.3K / month): ``` pip install dpdispatcher ``` -- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 8.7K · ⏱️ 21.01.2024): +- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 8.9K · ⏱️ 01.06.2024): ``` conda install -c conda-forge dpdispatcher ``` @@ -138,12 +138,12 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K
reacnetgenerator (🥈20 · ⭐ 61) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 35 · 📋 120 - 3% open · ⏱️ 17.05.2024): +- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 18 · 🔀 35 · 📋 120 - 3% open · ⏱️ 31.05.2024): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 1.3K / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 1K / month): ``` pip install reacnetgenerator ``` @@ -154,7 +154,7 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K
dflow (🥈18 · ⭐ 54) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 22 · 🔀 23 · 📋 35 - 40% open · ⏱️ 30.05.2024): +- [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 22 · 🔀 23 · 📋 35 - 40% open · ⏱️ 06.06.2024): ``` git clone https://github.com/deepmodeling/dflow @@ -167,47 +167,47 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` conda install -c conda-forge dflow ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dflow) (📥 3.3K · ⏱️ 30.05.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dflow) (📥 3.4K · ⏱️ 06.06.2024): ``` 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 · 📋 33 - 27% open · ⏱️ 29.05.2024): - - ``` - git clone https://github.com/deepmodeling/DeePTB - ``` -- [PyPi](https://pypi.org/project/dptb) (📥 160 / 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 · 📦 120 · 📋 7 - 14% open · ⏱️ 17.05.2024): +- [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 2 · 📦 120 · 📋 7 - 14% open · ⏱️ 03.06.2024): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 54K / month): +- [PyPi](https://pypi.org/project/dargs) (📥 58K / month): ``` pip install dargs ``` -- [Conda](https://anaconda.org/conda-forge/dargs) (📥 24K · ⏱️ 06.04.2024): +- [Conda](https://anaconda.org/conda-forge/dargs) (📥 24K · ⏱️ 03.06.2024): ``` conda install -c conda-forge dargs ```
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 · ⏱️ 19.05.2024): +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 23 · 🔀 55 · 📋 44 - 36% open · ⏱️ 19.05.2024): ``` 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 · 📋 34 - 26% open · ⏱️ 06.06.2024): + + ``` + git clone https://github.com/deepmodeling/DeePTB + ``` +- [PyPi](https://pypi.org/project/dptb) (📥 54 / month): + ``` + pip install dptb + ``` +
rid-kit (🥈15 · ⭐ 42) - Reinforced dynamics. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 21 · 📥 140 · ⏱️ 14.05.2024): @@ -215,7 +215,7 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 260 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 210 / month): ``` pip install rid-kit ``` @@ -227,47 +227,47 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/APEX ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 450 / month): +- [PyPi](https://pypi.org/project/apex-flow) (📥 490 / month): ``` pip install apex-flow ```
DP-GUI (🥈15 · ⭐ 7) - A web-based GUI for user inputs. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 3 · 🔀 4 · 📦 6 · ⏱️ 04.05.2024): +- [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 3 · 🔀 4 · 📦 6 · ⏱️ 31.05.2024): ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 30K / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 32K / month): ``` pip install dpgui ```
-
DPGEN2 (🥈14 · ⭐ 29 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +
DPGEN2 (🥈14 · ⭐ 29) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 13 · 🔀 22 · 📦 2 · 📋 30 - 40% open · ⏱️ 29.05.2024): +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 13 · 🔀 22 · 📦 2 · 📋 31 - 38% open · ⏱️ 04.06.2024): ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 52 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 49 / month): ``` pip install dpgen2 ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 2.4K · ⏱️ 29.05.2024): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 2.6K · ⏱️ 04.06.2024): ``` docker pull dptechnology/dpgen2 ```
JAX-FEM (🥈13 · ⭐ 170) - Differentiable Finite Element Method with JAX. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 7 · 🔀 29 · 📋 22 - 77% open · ⏱️ 17.05.2024): +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 7 · 🔀 30 · 📋 23 - 78% open · ⏱️ 17.05.2024): ``` git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 74 / month): +- [PyPi](https://pypi.org/project/jax-fem) (📥 98 / month): ``` pip install jax-fem ``` @@ -279,7 +279,7 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/DMFF ``` -- [Conda](https://anaconda.org/conda-forge/dmff) (📥 360 · ⏱️ 06.01.2024): +- [Conda](https://anaconda.org/conda-forge/dmff) (📥 380 · ⏱️ 06.01.2024): ``` conda install -c conda-forge dmff ``` @@ -291,7 +291,7 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 3K / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 3.2K / month): ``` pip install deepmodeling_sphinx ``` @@ -303,41 +303,41 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 190 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 160 / month): ``` npm install @deepmodeling/args ```
-
DeePKS-kit (🥉10 · ⭐ 96) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/deepks-kit) (👨‍💻 7 · 🔀 33 · 📋 18 - 27% open · ⏱️ 13.04.2024): - - ``` - git clone https://github.com/deepmodeling/deepks-kit - ``` -
-
fealpy (🥉10 · ⭐ 2) - Finite Element Analysis Library in Python. Unlicensed +
fealpy (🥉11 · ⭐ 3 · 📈) - Finite Element Analysis Library in Python. Unlicensed - [GitHub](https://github.com/deepmodeling/fealpy) (👨‍💻 57 · 🔀 2 · ⏱️ 24.04.2024): ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 78 / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 83 / month): ``` pip install fealpy ```
-
Uni-Fold (🥉8 · ⭐ 90 · 💤) - Apache-2 +
DeePKS-kit (🥉10 · ⭐ 96) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): +- [GitHub](https://github.com/deepmodeling/deepks-kit) (👨‍💻 7 · 🔀 33 · 📋 18 - 27% open · ⏱️ 13.04.2024): ``` - git clone https://github.com/deepmodeling/Uni-Fold + git clone https://github.com/deepmodeling/deepks-kit ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 620 · ⏱️ 08.01.2024): +
+
fpop (🥉9 · ⭐ 1 · 📈) - LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 3 · 🔀 8 · 📦 5 · ⏱️ 28.02.2024): + ``` - docker pull dptechnology/unifold + git clone https://github.com/deepmodeling/fpop + ``` +- [PyPi](https://pypi.org/project/fpop) (📥 1.3K / month): + ``` + pip install fpop ```
dpti (🥉8 · ⭐ 19) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 @@ -347,7 +347,7 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K ``` git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/dpti) (📥 15 / month): +- [PyPi](https://pypi.org/project/dpti) (📥 20 / month): ``` pip install dpti ``` @@ -360,16 +360,16 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K git clone https://github.com/deepmodeling/blog ```
-
fpop (🥉8 · ⭐ 1 · 📈) - LGPL-3.0 +
Uni-Fold (🥉7 · ⭐ 90 · 💤) - Apache-2 -- [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 3 · 🔀 8 · 📦 5 · ⏱️ 28.02.2024): +- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 18 · ⏱️ 18.08.2022): ``` - git clone https://github.com/deepmodeling/fpop + git clone https://github.com/deepmodeling/Uni-Fold ``` -- [PyPi](https://pypi.org/project/fpop) (📥 1K / month): +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 620 · ⏱️ 08.01.2024): ``` - pip install fpop + docker pull dptechnology/unifold ```
community (🥉7 · ⭐ 77) - DeepModeling community content. Unlicensed @@ -382,20 +382,12 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K
tbplas (🥉7 · ⭐ 6 · 🐣) - Repository of TBPLaS (tight-binding package for large-scale simulation). Unlicensed -- [GitHub](https://github.com/deepmodeling/tbplas) (👨‍💻 10 · 🔀 3 · ⏱️ 17.01.2024): +- [GitHub](https://github.com/deepmodeling/tbplas) (👨‍💻 10 · 🔀 4 · ⏱️ 17.01.2024): ``` git clone https://github.com/deepmodeling/tbplas ```
-
docs (🥉7 · ⭐ 3) - The home page of DeepModeling documentation. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/docs) (👨‍💻 8 · 🔀 7 · ⏱️ 11.04.2024): - - ``` - git clone https://github.com/deepmodeling/docs - ``` -
AI4Science101 (🥉6 · ⭐ 82 · 💤) - AI for Science. Unlicensed - [GitHub](https://github.com/deepmodeling/AI4Science101) (👨‍💻 5 · 🔀 13 · ⏱️ 04.09.2022): @@ -420,6 +412,14 @@ This curated list contains 36 awesome open-source projects with a total of 3.1K git clone https://github.com/deepmodeling/AIS-Square ```
+
docs (🥉6 · ⭐ 3 · 📉) - The home page of DeepModeling documentation. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/docs) (👨‍💻 8 · 🔀 7 · ⏱️ 11.04.2024): + + ``` + git clone https://github.com/deepmodeling/docs + ``` +
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/2024-06-06_changes.md b/history/2024-06-06_changes.md new file mode 100644 index 0000000..b74b6af --- /dev/null +++ b/history/2024-06-06_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._ + +- fealpy (🥉11 · ⭐ 3 · 📈) - Finite Element Analysis Library in Python. Unlicensed +- fpop (🥉9 · ⭐ 1 · 📈) - 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._ + +- DeePTB (🥈16 · ⭐ 32 · 📉) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +- Uni-Fold (🥉7 · ⭐ 90 · 💤) - Apache-2 +- docs (🥉6 · ⭐ 3 · 📉) - The home page of DeepModeling documentation. LGPL-3.0 + diff --git a/history/2024-06-06_projects.csv b/history/2024-06-06_projects.csv new file mode 100644 index 0000000..d4e7fff --- /dev/null +++ b/history/2024-06-06_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 15:23:44,2024-06-06 18:04:06.000000,2024-04-06 18:46:23,2501,42.0,468,47,1881,73.0,622.0,1391.0,2024-04-06 19:28:14,2.2.10,37050.0,18328.0,44.0,A deep learning package for many-body potential energy representation and molecular dynamics.,14.0,14.0,68,https://pypi.org/project/deepmd-kit,1260.0,https://anaconda.org/conda-forge/deepmd-kit,2024-06-05 03:32:31.061,621613.0,https://www.npmjs.com/package/deepmd-kit,8.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2024-03-04 00:17:27.208639,1.0,2296.0,28,True,others,1, +1,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 13:24:23,2024-06-06 09:47:49.000000,2024-06-06 00:03:38,724,39.0,122,9,463,17.0,75.0,186.0,2024-06-06 00:06:28,0.2.19,,34409.0,35.0,"Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc.",118.0,118.0,60,https://pypi.org/project/dpdata,32923.0,https://anaconda.org/conda-forge/dpdata,2024-06-06 04:58:08.772,68348.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,82.0,24,True,others,1, +2,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 04:04:52,2024-06-06 15:05:38.000000,2024-06-04 14:48:55,6304,216.0,117,11,2719,223.0,1301.0,146.0,2024-05-24 10:06:37,3.6.4,,4612.0,49.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,116,,,https://anaconda.org/conda-forge/abacus,2024-05-27 02:47:26.519,50735.0,,,,,,,24,True,others,1, +3,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2024-06-04 07:35:57.000000,2024-04-10 06:31:36,2083,10.0,167,13,811,26.0,258.0,284.0,2024-04-10 06:37:07,0.12.1,1707.0,1018.0,18.0,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,393.0,https://anaconda.org/conda-forge/dpgen,2024-04-10 09:44:30.012,28530.0,,,,,,,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 05:14:37,2024-06-03 21:38:18.000000,2024-05-29 20:43:18,1071,21.0,53,6,369,16.0,55.0,40.0,2024-05-27 14:47:51,0.6.5,,5004.0,45.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,47.0,47.0,46,https://pypi.org/project/dpdispatcher,2264.0,https://anaconda.org/conda-forge/dpdispatcher,2024-06-01 21:08:27.095,8920.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2024-05-27 14:51:33.131309,,97274.0,22,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 15:07:56,2024-06-05 17:55:17.000000,2024-05-31 05:28:19,2476,63.0,35,9,2097,4.0,120.0,61.0,2024-05-09 23:35:17,1.6.13,,7397.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,,,18,https://pypi.org/project/reacnetgenerator,1048.0,https://anaconda.org/conda-forge/reacnetgenerator,2024-05-10 07:03:30.570,311106.0,,,,,,,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 08:14:36,2024-06-06 07:49:45.380292,2024-06-06 07:46:47,2034,103.0,23,1,795,14.0,21.0,54.0,2024-06-06 07:48:17,1.8.77,,115.0,100.0,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,2024-06-06 07:49:45.380292,,3350.0,18,True,others,2, +7,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2024-06-03 21:38:13.000000,2024-06-03 06:55:38,141,19.0,2,7,58,1.0,6.0,5.0,2024-06-03 06:49:27,0.4.6,,58236.0,27.0,Argument processing for the deep modeling project.,118.0,118.0,7,https://pypi.org/project/dargs,57595.0,https://anaconda.org/conda-forge/dargs,2024-06-03 12:02:44.589,24393.0,,,,,,,17,True,others,2, +8,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2024-06-03 09:57:54.000000,2024-05-19 15:02:18,1055,14.0,55,7,436,16.0,28.0,123.0,2024-03-02 04:46:26,1.3.1,,,19.0,A deep learning empowered open-source platform for reacting flow simulations.,,,23,,,,,,,,,,,,16,True,others,2, +9,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2024-06-06 13:42:36.000000,2024-06-06 13:42:35,704,136.0,12,4,149,9.0,25.0,32.0,2024-05-06 09:35:40,2.0.2,,54.0,8.0,DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.,,,9,https://pypi.org/project/dptb,54.0,,,,,,,,,,16,True,others,2,-1.0 +10,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 02:44:00,2024-05-14 03:22:33.000000,2024-05-14 03:22:27,473,4.0,21,5,21,,3.0,42.0,2024-05-14 03:25:35,0.6.4,143.0,218.0,5.0,Reinforced dynamics.,,,14,https://pypi.org/project/rid-kit,214.0,,,,,,,,,,15,True,others,2, +11,APEX,deepmodeling/APEX,apex-flow,,,,https://github.com/deepmodeling/APEX,https://github.com/deepmodeling/APEX,LGPL-3.0,2023-04-20 06:13:42,2024-05-06 10:01:52.000000,2024-05-06 09:59:20,529,135.0,15,7,62,1.0,5.0,19.0,2024-05-06 10:01:52,1.2.0,,490.0,4.0,APEX: Alloy Properties EXplorer using simulations.,,,6,https://pypi.org/project/apex-flow,490.0,,,,,,,,,,15,True,others,2, +12,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2024-06-06 10:50:05.000000,2024-05-31 07:44:25,304,26.0,4,6,448,,1.0,7.0,2023-10-13 05:16:09,1.0.0,,31754.0,4.0,A web-based GUI for user inputs.,6.0,6.0,3,https://pypi.org/project/dpgui,31754.0,,,,,,,,,,15,True,others,2, +13,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2024-06-04 14:46:26.827882,2024-06-04 14:44:02,286,30.0,22,7,194,12.0,19.0,29.0,2023-01-28 03:43:25,0.0.7,,141.0,7.0,2nd generation of the Deep Potential GENerator.,2.0,2.0,13,https://pypi.org/project/dpgen2,49.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2024-06-04 14:46:26.827882,,2602.0,14,True,others,2, +14,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 15:20:54,2024-05-17 13:28:22.000000,2024-05-17 13:28:16,188,25.0,30,9,4,18.0,5.0,173.0,,,,98.0,,Differentiable Finite Element Method with JAX.,,,7,https://pypi.org/project/jax-fem,98.0,,,,,,,,,,13,True,others,2, +15,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2024-06-03 09:49:56.000000,2024-01-12 00:58:20,431,,40,9,158,10.0,16.0,140.0,2023-11-09 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 07:33:02.470,383.0,,,,,,,13,True,others,2, +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 00:19:06,2024-06-03 21:38:12.000000,2024-05-14 22:54:20,66,11.0,6,5,58,,,2.0,2024-05-14 22:54:34,0.2.8,,3217.0,21.0,Sphinx extension for DeepModeling projects.,,,7,https://pypi.org/project/deepmodeling_sphinx,3217.0,,,,,,,,,,13,True,others,2, +17,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2024-05-28 00:15:20.000000,2024-05-28 00:15:19,72,14.0,2,6,44,,,2.0,2024-04-11 23:49:50,0.0.17,,155.0,16.0,DeepModeling dargs arguments generation.,5.0,5.0,3,,,,,,https://www.npmjs.com/package/@deepmodeling/args,155.0,,,,,12,True,others,3, +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 01:36:31,6125,227.0,2,1,1,,,3.0,,,,83.0,,Finite Element Analysis Library in Python.,,,57,https://pypi.org/project/fealpy,83.0,,,,,,,,,,11,True,others,3,1.0 +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 03:44:40,384,4.0,33,14,42,5.0,13.0,96.0,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7,,,,,,,,,,,,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 03:16:47,2024-04-11 02:10:46.000000,2024-02-28 06:09:59,38,,8,9,21,3.0,,1.0,,,,1332.0,,,5.0,5.0,3,https://pypi.org/project/fpop,1332.0,,,,,,,,,,9,True,others,3,1.0 +21,dpti,deepmodeling/dpti,dpti,,,,https://github.com/deepmodeling/dpti,https://github.com/deepmodeling/dpti,LGPL-3.0,2021-04-04 13:57:37,2024-06-03 21:39:16.000000,2024-04-13 06:51:36,394,8.0,20,7,58,7.0,,19.0,,,,20.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,,,16,https://pypi.org/project/dpti,20.0,,,,,,,,,,8,True,others,3, +22,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2024-05-04 21:07:29.000000,2024-05-04 21:06:41,167,10.0,7,6,94,,,1.0,,,,,,DeepModeling Blog.,,,7,,,,,,,,,,,,8,True,others,3, +23,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,,,,20.0,,,,,3,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,615.0,7,True,others,3,-1.0 +24,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2024-04-26 08:53:41.000000,2024-03-29 10:48:54,106,10.0,18,11,35,,2.0,77.0,,,,,,DeepModeling community content.,,,15,,,,,,,,,,,,7,True,others,3, +25,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,,4,9,2,1.0,,6.0,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10,,,,,,,,,,,,7,True,others,3, +26,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, +27,tutorials,deepmodeling/tutorials,,,,,https://github.com/deepmodeling/tutorials,https://github.com/deepmodeling/tutorials,,2022-03-07 06:19:19,2024-05-06 20:57:28.000000,2022-09-26 07:49:48,136,,22,5,63,,2.0,13.0,,,,,,Tutorials for DeepModeling projects.,,,10,,,,,,,,,,,,6,True,others,3, +28,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2024-05-15 06:52:35.000000,2023-12-06 03:06:55,469,,8,8,210,5.0,1.0,10.0,,,,,,,,,8,,,,,,,,,,,,6,True,others,3, +29,docs,deepmodeling/docs,,,,,https://github.com/deepmodeling/docs,https://github.com/deepmodeling/docs,LGPL-3.0,2021-07-05 00:32:29,2024-04-11 04:19:01.000000,2024-04-11 04:19:01,27,2.0,7,5,22,,,3.0,,,,,,The home page of DeepModeling documentation.,,,8,,,,,,,,,,,,6,True,others,3,-1.0 +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 a53a214..b74b6af 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,11 +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._ -- fpop (🥉8 · ⭐ 1 · 📈) - LGPL-3.0 +- fealpy (🥉11 · ⭐ 3 · 📈) - Finite Element Analysis Library in Python. Unlicensed +- fpop (🥉9 · ⭐ 1 · 📈) - 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._ -- DPGEN2 (🥈14 · ⭐ 29 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +- DeePTB (🥈16 · ⭐ 32 · 📉) - DeePTB: A deep learning package for tight-binding approach with ab initio accuracy. LGPL-3.0 +- Uni-Fold (🥉7 · ⭐ 90 · 💤) - Apache-2 +- docs (🥉6 · ⭐ 3 · 📉) - The home page of DeepModeling documentation. LGPL-3.0