diff --git a/README.md b/README.md index 85786cd..51e25da 100644 --- a/README.md +++ b/README.md @@ -44,33 +44,33 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K Back to top -
DeePMD-kit (🥇29 · ⭐ 1.7K) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 +
DeePMD-kit (🥇28 · ⭐ 1.7K) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 79 · 🔀 540 · 📥 57K · 📦 36 · 📋 900 - 9% open · ⏱️ 11.06.2025): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 9.5K / month): +- [PyPi](https://pypi.org/project/deepmd-kit): ``` pip install deepmd-kit ``` -- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 2M · ⏱️ 11.06.2025): +- [Conda](https://anaconda.org/conda-forge/deepmd-kit) (📥 2.1M · ⏱️ 11.06.2025): ``` conda install -c conda-forge deepmd-kit ``` -- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 11 / month): +- [npm](https://www.npmjs.com/package/deepmd-kit) (📥 4 / month): ``` npm install deepmd-kit ``` -- [Docker Hub](https://hub.docker.com/r/deepmodeling/deepmd-kit) (📥 3.9K · ⭐ 1 · ⏱️ 12.06.2025): +- [Docker Hub](https://hub.docker.com/r/deepmodeling/deepmd-kit) (📥 4K · ⭐ 1 · ⏱️ 12.06.2025): ``` docker pull deepmodeling/deepmd-kit ```
ABACUS (🥇24 · ⭐ 210) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 130 · 🔀 150 · 📋 2.3K - 6% open · ⏱️ 31.07.2025): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 130 · 🔀 150 · 📋 2.3K - 6% open · ⏱️ 04.08.2025): ``` git clone https://github.com/deepmodeling/abacus-develop @@ -82,12 +82,12 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K
DP-GEN (🥇23 · ⭐ 350) - 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) (👨‍💻 69 · 🔀 180 · 📥 2K · 📦 8 · 📋 320 - 14% open · ⏱️ 21.02.2025): +- [GitHub](https://github.com/deepmodeling/dpgen) (👨‍💻 71 · 🔀 180 · 📥 2K · 📦 8 · 📋 320 - 14% open · ⏱️ 07.08.2025): ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 600 / month): +- [PyPi](https://pypi.org/project/dpgen): ``` pip install dpgen ``` @@ -96,18 +96,18 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K conda install -c conda-forge dpgen ```
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dpdata (🥇23 · ⭐ 210) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 +
dpdata (🥇23 · ⭐ 220) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 62 · 🔀 140 · 📦 140 · 📋 120 - 20% open · ⏱️ 20.03.2025): +- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 65 · 🔀 140 · 📦 140 · 📋 120 - 20% open · ⏱️ 03.08.2025): ``` git clone https://github.com/deepmodeling/dpdata ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 16K / month): +- [PyPi](https://pypi.org/project/dpdata): ``` pip install dpdata ``` -- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 110K · ⏱️ 22.04.2025): +- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 110K · ⏱️ 03.08.2025): ``` conda install -c conda-forge dpdata ``` @@ -116,38 +116,38 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K docker pull dptechnology/dpdata ```
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dpdispatcher (🥈21 · ⭐ 51) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. LGPL-3.0 +
dpdispatcher (🥈22 · ⭐ 51 · 📈) - 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 · 🔀 55 · 📦 65 · 📋 87 - 24% open · ⏱️ 24.06.2025): +- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 46 · 🔀 55 · 📦 67 · 📋 87 - 22% open · ⏱️ 07.08.2025): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 1.4K / month): +- [PyPi](https://pypi.org/project/dpdispatcher): ``` pip install dpdispatcher ``` -- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 31K · ⏱️ 03.06.2025): +- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 31K · ⏱️ 01.08.2025): ``` conda install -c conda-forge dpdispatcher ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpdispatcher) (📥 130K · ⏱️ 02.06.2025): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpdispatcher) (📥 130K · ⏱️ 01.08.2025): ``` docker pull dptechnology/dpdispatcher ```
reacnetgenerator (🥈20 · ⭐ 91) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 19 · 🔀 40 · 📦 3 · 📋 130 - 5% open · ⏱️ 20.06.2025): +- [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 19 · 🔀 40 · 📦 3 · 📋 130 - 5% open · ⏱️ 03.08.2025): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 2.5K / month): +- [PyPi](https://pypi.org/project/reacnetgenerator): ``` pip install reacnetgenerator ``` -- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 630K · ⏱️ 22.04.2025): +- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 640K · ⏱️ 22.04.2025): ``` conda install -c conda-forge reacnetgenerator ``` @@ -167,7 +167,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K ``` conda install -c conda-forge dflow ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dflow) (📥 13K · ⏱️ 20.07.2025): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dflow) (📥 14K · ⏱️ 20.07.2025): ``` docker pull dptechnology/dflow ``` @@ -180,26 +180,42 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K git clone https://github.com/deepmodeling/deepflame-dev ```
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DeePTB (🥈18 · ⭐ 83) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 +
DeePTB (🥈16 · ⭐ 83 · 📉) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 11 · 🔀 21 · 📦 4 · 📋 51 - 33% open · ⏱️ 20.07.2025): +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 11 · 🔀 22 · 📦 4 · 📋 51 - 33% open · ⏱️ 20.07.2025): ``` git clone https://github.com/deepmodeling/DeePTB ``` -- [PyPi](https://pypi.org/project/dptb) (📥 170 / month): +- [PyPi](https://pypi.org/project/dptb): ``` pip install dptb ```
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dargs (🥈17 · ⭐ 6) - Argument processing for the deep modeling project. LGPL-3.0 +
DPGEN2 (🥈15 · ⭐ 40) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 16 · 🔀 34 · 📦 6 · 📋 35 - 34% open · ⏱️ 05.08.2025): + + ``` + git clone https://github.com/deepmodeling/dpgen2 + ``` +- [PyPi](https://pypi.org/project/dpgen2): + ``` + pip install dpgen2 + ``` +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 4K · ⏱️ 05.08.2025): + ``` + docker pull dptechnology/dpgen2 + ``` +
+
dargs (🥈15 · ⭐ 6 · 💤) - Argument processing for the deep modeling project. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 7 · 🔀 3 · 📦 150 · 📋 9 - 22% open · ⏱️ 28.01.2025): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 24K / month): +- [PyPi](https://pypi.org/project/dargs): ``` pip install dargs ``` @@ -208,135 +224,99 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K conda install -c conda-forge dargs ```
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JAX-FEM (🥈16 · ⭐ 450) - Differentiable Finite Element Method with JAX. GPL-3.0 +
JAX-FEM (🥈14 · ⭐ 460) - Differentiable Finite Element Method with JAX. GPL-3.0 -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 10 · 🔀 75 · 📦 3 · 📋 56 - 55% open · ⏱️ 28.07.2025): +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 11 · 🔀 77 · 📦 3 · 📋 58 - 56% open · ⏱️ 05.08.2025): ``` git clone https://github.com/deepmodeling/jax-fem ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 400 / month): +- [PyPi](https://pypi.org/project/jax-fem): ``` pip install jax-fem ```
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DPGEN2 (🥈15 · ⭐ 40 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 +
DMFF (🥈13 · ⭐ 180) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 16 · 🔀 34 · 📦 6 · 📋 35 - 34% open · ⏱️ 25.07.2025): +- [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 16 · 🔀 46 · 📋 28 - 32% open · ⏱️ 06.08.2025): ``` - git clone https://github.com/deepmodeling/dpgen2 - ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 48 / month): - ``` - pip install dpgen2 + git clone https://github.com/deepmodeling/DMFF ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpgen2) (📥 4K · ⏱️ 25.07.2025): +- [Conda](https://anaconda.org/conda-forge/dmff) (📥 2.3K · ⏱️ 22.04.2025): ``` - docker pull dptechnology/dpgen2 + conda install -c conda-forge dmff ```
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APEX (🥈15 · ⭐ 36) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +
APEX (🥈12 · ⭐ 37 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/APEX) (👨‍💻 7 · 🔀 22 · 📦 4 · 📋 9 - 11% open · ⏱️ 10.04.2025): ``` git clone https://github.com/deepmodeling/APEX ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 310 / month): +- [PyPi](https://pypi.org/project/apex-flow): ``` pip install apex-flow ```
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DMFF (🥈14 · ⭐ 180) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 +
rid-kit (🥈11 · ⭐ 49) - Reinforced dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 14 · 🔀 46 · 📋 28 - 39% open · ⏱️ 10.04.2025): +- [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 23 · 📥 150 · 📦 2 · 📋 5 - 40% open · ⏱️ 31.03.2025): ``` - git clone https://github.com/deepmodeling/DMFF + git clone https://github.com/deepmodeling/rid-kit ``` -- [Conda](https://anaconda.org/conda-forge/dmff) (📥 2.3K · ⏱️ 22.04.2025): +- [PyPi](https://pypi.org/project/rid-kit): ``` - conda install -c conda-forge dmff + pip install rid-kit ```
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DP-GUI (🥈14 · ⭐ 8) - A web-based GUI for user inputs. LGPL-3.0 +
DP-GUI (🥉10 · ⭐ 8 · 📉) - A web-based GUI for user inputs. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 4 · 🔀 5 · 📦 13 · ⏱️ 13.03.2025): ``` git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dpgui) (📥 11K / month): +- [PyPi](https://pypi.org/project/dpgui): ``` pip install dpgui ```
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deepmodeling_sphinx (🥉12 · ⭐ 3 · 📉) - Sphinx extension for DeepModeling projects. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 7 · 🔀 6 · ⏱️ 22.03.2025): - - ``` - git clone https://github.com/deepmodeling/deepmodeling_sphinx - ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 980 / month): - ``` - pip install deepmodeling_sphinx - ``` -
-
rid-kit (🥉11 · ⭐ 49 · 📉) - Reinforced dynamics. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/rid-kit) (👨‍💻 14 · 🔀 23 · 📥 150 · 📦 2 · 📋 5 - 40% open · ⏱️ 31.03.2025): - - ``` - git clone https://github.com/deepmodeling/rid-kit - ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 17 / month): - ``` - pip install rid-kit - ``` -
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GPUMD (🥉11 · ⭐ 9) - Graphics Processing Units Molecular Dynamics. GPL-3.0 +
Blog (🥉10 · ⭐ 3) - DeepModeling Blog. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 49 · ⏱️ 16.05.2025): +- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 10 · 🔀 9 · ⏱️ 28.07.2025): ``` - git clone https://github.com/deepmodeling/GPUMD + git clone https://github.com/deepmodeling/blog ```
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fealpy (🥉10 · ⭐ 6 · 📉) - Finite Element Analysis Library in Python. Unlicensed +
deepmodeling_sphinx (🥉10 · ⭐ 3) - Sphinx extension for DeepModeling projects. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/fealpy) (👨‍💻 69 · 🔀 2 · ⏱️ 28.04.2025): +- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 7 · 🔀 6 · ⏱️ 22.03.2025): ``` - git clone https://github.com/deepmodeling/fealpy - ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 270 / month): - ``` - pip install fealpy + git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -
-
Blog (🥉10 · ⭐ 3) - DeepModeling Blog. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 10 · 🔀 9 · ⏱️ 28.07.2025): - +- [PyPi](https://pypi.org/project/deepmodeling_sphinx): ``` - git clone https://github.com/deepmodeling/blog + pip install deepmodeling_sphinx ```
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args (🥉10 · ⭐ 2 · 📉) - DeepModeling dargs arguments generation. LGPL-3.0 +
args (🥉10 · ⭐ 2) - DeepModeling dargs arguments generation. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/args) (👨‍💻 3 · 🔀 2 · 📦 5 · ⏱️ 06.03.2025): ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 130 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 120 / month): ``` npm install @deepmodeling/args ```
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DeePKS-kit (🥉9 · ⭐ 110 · 📈) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 +
DeePKS-kit (🥉9 · ⭐ 110) - 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 · 🔀 36 · 📋 30 - 43% open · ⏱️ 28.04.2025): @@ -352,7 +332,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K git clone https://github.com/deepmodeling/community ```
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AIS-Square (🥉9 · ⭐ 13 · 📈) - LGPL-3.0 +
AIS-Square (🥉9 · ⭐ 13) - LGPL-3.0 - [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 8 · 📋 6 - 83% open · ⏱️ 30.07.2025): @@ -360,6 +340,14 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K git clone https://github.com/deepmodeling/AIS-Square ```
+
GPUMD (🥉9 · ⭐ 9) - Graphics Processing Units Molecular Dynamics. GPL-3.0 + +- [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 49 · ⏱️ 16.05.2025): + + ``` + git clone https://github.com/deepmodeling/GPUMD + ``` +
dpti (🥉8 · ⭐ 29) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 17 · 🔀 19 · 📦 2 · 📋 10 - 90% open · ⏱️ 15.03.2025): @@ -367,33 +355,45 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K ``` git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/dpti) (📥 3 / month): +- [PyPi](https://pypi.org/project/dpti): ``` pip install dpti ```
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fpop (🥉8 · ⭐ 2 · 💤) - LGPL-3.0 +
Uni-Fold (🥉7 · ⭐ 92 · 💤) - Apache-2 -- [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 4 · 🔀 11 · 📦 15 · ⏱️ 01.07.2024): +- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 19 · ⏱️ 18.08.2022): ``` - git clone https://github.com/deepmodeling/fpop + git clone https://github.com/deepmodeling/Uni-Fold ``` -- [PyPi](https://pypi.org/project/fpop) (📥 250 / month): +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 1.1K · ⏱️ 08.01.2024): ``` - pip install fpop + docker pull dptechnology/unifold ```
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Uni-Fold (🥉7 · ⭐ 92 · 💤) - Apache-2 +
fealpy (🥉7 · ⭐ 6 · 📉) - Finite Element Analysis Library in Python. Unlicensed -- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 19 · ⏱️ 18.08.2022): +- [GitHub](https://github.com/deepmodeling/fealpy) (👨‍💻 69 · 🔀 2 · ⏱️ 28.04.2025): ``` - git clone https://github.com/deepmodeling/Uni-Fold + git clone https://github.com/deepmodeling/fealpy ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 1.1K · ⏱️ 08.01.2024): +- [PyPi](https://pypi.org/project/fealpy): ``` - docker pull dptechnology/unifold + pip install fealpy + ``` +
+
fpop (🥉7 · ⭐ 3 · 💤) - LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/fpop) (👨‍💻 4 · 🔀 12 · 📦 15 · ⏱️ 01.07.2024): + + ``` + git clone https://github.com/deepmodeling/fpop + ``` +- [PyPi](https://pypi.org/project/fpop): + ``` + pip install fpop ```
tutorials (🥉6 · ⭐ 15) - Tutorials for DeepModeling projects. Unlicensed @@ -420,7 +420,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K git clone https://github.com/deepmodeling/docs ```
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AI4Science101 (🥉5 · ⭐ 96 · 💤) - AI for Science. Unlicensed +
AI4Science101 (🥉5 · ⭐ 97 · 💤) - AI for Science. Unlicensed - [GitHub](https://github.com/deepmodeling/AI4Science101) (👨‍💻 5 · 🔀 15 · ⏱️ 04.09.2022): @@ -430,7 +430,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K
DeePDih (🥉5 · ⭐ 6) - Deep Potential driven molecular dihedral scan toolkit. MIT -- [GitHub](https://github.com/deepmodeling/DeePDih) (🔀 3 · 📥 6 · ⏱️ 14.07.2025): +- [GitHub](https://github.com/deepmodeling/DeePDih) (🔀 3 · 📥 6 · ⏱️ 05.08.2025): ``` git clone https://github.com/deepmodeling/DeePDih @@ -460,7 +460,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.3K git clone https://github.com/deepmodeling/ADMP ```
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LibRI (🥉2 · ⭐ 6) - GPL-3.0 +
LibRI (🥉2 · ⭐ 6 · 💤) - GPL-3.0 - [GitHub](https://github.com/deepmodeling/LibRI) (👨‍💻 3 · 🔀 1 · 📋 3 - 66% open · ⏱️ 10.01.2025): diff --git a/history/2025-08-07_changes.md b/history/2025-08-07_changes.md new file mode 100644 index 0000000..08dca12 --- /dev/null +++ b/history/2025-08-07_changes.md @@ -0,0 +1,16 @@ +## 📈 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._ + +- dpdispatcher (🥈22 · ⭐ 51 · 📈) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. 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 · ⭐ 83 · 📉) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 +- dargs (🥈15 · ⭐ 6 · 💤) - Argument processing for the deep modeling project. LGPL-3.0 +- APEX (🥈12 · ⭐ 37 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +- DP-GUI (🥉10 · ⭐ 8 · 📉) - A web-based GUI for user inputs. LGPL-3.0 +- fealpy (🥉7 · ⭐ 6 · 📉) - Finite Element Analysis Library in Python. Unlicensed + diff --git a/history/2025-08-07_projects.csv b/history/2025-08-07_projects.csv new file mode 100644 index 0000000..86dc04b --- /dev/null +++ b/history/2025-08-07_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,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 15:23:44,2025-08-07 16:10:13.000000,2025-06-11 05:53:58,3314,40.0,543.0,46.0,2458.0,87.0,816.0,1726,2025-06-11 06:01:47,3.1.0,57420.0,40358.0,58.0,A deep learning package for many-body potential energy representation and molecular dynamics.,36.0,36.0,79.0,https://pypi.org/project/deepmd-kit,https://anaconda.org/conda-forge/deepmd-kit,2025-06-11 11:42:47.882,2053005.0,https://www.npmjs.com/package/deepmd-kit,4.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2025-06-12 14:06:06.712335,1.0,3952.0,28,True,others,1.0, +1,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 04:04:52,2025-08-04 09:56:47.000000,2025-08-04 03:09:53,7368,126.0,146.0,10.0,3965.0,144.0,2187.0,209,2025-08-02 11:43:44,3.9.0.11,,18285.0,75.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,128.0,,https://anaconda.org/conda-forge/abacus,2025-04-22 14:58:45.321,457140.0,,,,,,,24,True,others,1.0, +2,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2025-08-07 07:42:11.000000,2025-08-07 07:41:08,2197,17.0,177.0,11.0,904.0,47.0,278.0,353,2025-08-07 07:42:12,0.13.2,1966.0,722.0,21.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,8.0,8.0,71.0,https://pypi.org/project/dpgen,https://anaconda.org/conda-forge/dpgen,2025-04-22 14:57:10.509,43076.0,,,,,,,23,True,others,1.0, +3,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 13:24:23,2025-08-07 07:29:50.000000,2025-08-03 10:52:22,842,21.0,141.0,6.0,594.0,24.0,94.0,215,2025-08-03 10:54:49,0.2.25,,1766.0,41.0,A Python package for manipulating atomistic data of software in computational science.,145.0,145.0,65.0,https://pypi.org/project/dpdata,https://anaconda.org/conda-forge/dpdata,2025-08-03 16:36:05.688,105500.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,648.0,23,True,others,1.0, +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 05:14:37,2025-08-07 14:33:04.000000,2025-08-07 14:33:03,1108,4.0,55.0,5.0,414.0,20.0,67.0,51,2025-08-01 08:37:53,0.6.10,,3198.0,50.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,67.0,67.0,46.0,https://pypi.org/project/dpdispatcher,https://anaconda.org/conda-forge/dpdispatcher,2025-08-01 11:39:47.033,30664.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2025-08-01 08:41:48.333400,,130085.0,22,True,others,2.0,1.0 +5,reacnetgenerator,deepmodeling/reacnetgenerator,reacnetgenerator,conda-forge/reacnetgenerator,,,https://github.com/deepmodeling/reacnetgenerator,https://github.com/deepmodeling/reacnetgenerator,LGPL-3.0,2018-04-06 15:07:56,2025-08-04 20:23:02.000000,2025-08-03 13:13:38,2540,17.0,40.0,7.0,2229.0,7.0,123.0,91,2025-01-05 07:30:15,1.6.15,,10083.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,3.0,3.0,19.0,https://pypi.org/project/reacnetgenerator,https://anaconda.org/conda-forge/reacnetgenerator,2025-04-22 14:57:18.750,635273.0,,,,,,,20,True,others,2.0, +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 08:14:36,2025-07-20 01:22:47.163503,2025-07-20 01:20:02,2249,50.0,28.0,1.0,901.0,14.0,22.0,71,2025-07-20 01:20:20,1.8.127,,314.0,100.0,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,2025-07-20 01:22:47.163503,,13512.0,19,True,others,2.0, +7,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2025-07-23 10:53:06.000000,2025-07-23 10:47:26,1176,31.0,70.0,8.0,509.0,21.0,30.0,183,2025-06-26 04:29:15,1.6.0,,,22.0,A deep learning empowered open-source platform for reacting flow simulations.,,,29.0,,,,,,,,,,,18,True,others,2.0, +8,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2025-07-20 16:16:36.000000,2025-07-20 16:15:35,795,10.0,22.0,3.0,212.0,17.0,34.0,83,2025-05-07 14:02:40,2.2.0,,,12.0,DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy.,4.0,4.0,11.0,https://pypi.org/project/dptb,,,,,,,,,,16,True,others,2.0,-2.0 +9,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2025-08-05 00:43:54.585184,2025-08-05 00:42:27,339,6.0,34.0,6.0,257.0,12.0,23.0,40,2023-01-28 03:43:25,0.0.7,,95.0,7.0,2nd generation of the Deep Potential GENerator.,6.0,6.0,16.0,https://pypi.org/project/dpgen2,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2025-08-05 00:43:54.585184,,3991.0,15,True,others,2.0, +10,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2025-08-04 20:22:52.000000,2025-01-28 03:24:29,163,,3.0,5.0,81.0,2.0,7.0,6,2024-11-21 03:25:26,0.4.10,,961.0,31.0,Argument processing for the deep modeling project.,149.0,149.0,7.0,https://pypi.org/project/dargs,https://anaconda.org/conda-forge/dargs,2025-04-22 14:57:50.542,49981.0,,,,,,,15,True,others,2.0,-2.0 +11,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 15:20:54,2025-08-05 13:50:05.000000,2025-08-05 13:49:02,237,25.0,77.0,12.0,8.0,33.0,25.0,461,,,,,,Differentiable Finite Element Method with JAX.,3.0,3.0,11.0,https://pypi.org/project/jax-fem,,,,,,,,,,14,True,others,2.0, +12,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2025-08-06 13:28:30.000000,2025-08-06 00:16:18,438,2.0,46.0,9.0,171.0,9.0,19.0,176,2023-11-09 14:32:37,1.0.0,,121.0,4.0,DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable..,,,16.0,,https://anaconda.org/conda-forge/dmff,2025-04-22 14:58:55.028,2313.0,,,,,,,13,True,others,2.0, +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,,22.0,7.0,88.0,1.0,8.0,37,2024-05-06 10:01:52,1.2.0,,,4.0,APEX: Alloy Properties EXplorer using simulations.,4.0,4.0,7.0,https://pypi.org/project/apex-flow,,,,,,,,,,12,True,others,2.0,-3.0 +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 02:44:00,2025-03-31 04:23:22.000000,2025-03-31 04:21:54,477,,23.0,4.0,21.0,2.0,3.0,49,2024-05-14 03:25:35,0.6.4,148.0,3.0,5.0,Reinforced dynamics.,2.0,2.0,14.0,https://pypi.org/project/rid-kit,,,,,,,,,,11,True,others,2.0, +15,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2025-08-04 20:23:14.000000,2025-03-13 03:19:56,324,,5.0,6.0,535.0,,1.0,8,2024-11-17 07:05:49,1.0.1.post0,,,5.0,A web-based GUI for user inputs.,13.0,13.0,4.0,https://pypi.org/project/dpgui,,,,,,,,,,10,True,others,3.0,-4.0 +16,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2025-07-28 06:54:35.000000,2025-07-28 06:54:34,369,72.0,9.0,6.0,316.0,,,3,,,,,,DeepModeling Blog.,,,10.0,,,,,,,,,,,10,True,others,3.0, +17,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 00:19:06,2025-08-04 20:22:51.000000,2025-03-22 17:20:16,77,,6.0,5.0,70.0,,,3,2025-03-22 17:20:41,0.3.1,,,25.0,Sphinx extension for DeepModeling projects.,,,7.0,https://pypi.org/project/deepmodeling_sphinx,,,,,,,,,,10,True,others,3.0, +18,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2025-08-04 19:46:54.000000,2025-03-06 02:44:30,83,,2.0,5.0,58.0,,,2,2025-03-06 02:44:56,0.1.1,,117.0,18.0,DeepModeling dargs arguments generation.,5.0,5.0,3.0,,,,,https://www.npmjs.com/package/@deepmodeling/args,117.0,,,,,10,True,others,3.0, +19,DeePKS-kit,deepmodeling/deepks-kit,,,,,https://github.com/deepmodeling/deepks-kit,https://github.com/deepmodeling/deepks-kit,LGPL-3.0,2020-07-29 03:27:50,2025-04-28 21:22:59.000000,2025-04-28 21:22:58,385,,36.0,13.0,47.0,13.0,17.0,112,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7.0,,,,,,,,,,,9,True,others,3.0, +20,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2025-06-12 05:57:22.000000,2025-06-12 05:57:22,165,21.0,23.0,10.0,51.0,,2.0,88,,,,,,DeepModeling community content.,,,19.0,,,,,,,,,,,9,True,others,3.0, +21,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2025-07-30 03:01:53.000000,2025-07-30 03:01:52,1114,106.0,8.0,8.0,210.0,5.0,1.0,13,,,,,,,,,8.0,,,,,,,,,,,9,True,others,3.0, +22,GPUMD,deepmodeling/GPUMD,,,,,https://github.com/deepmodeling/GPUMD,https://github.com/deepmodeling/GPUMD,GPL-3.0,2024-06-18 05:40:21,2025-05-16 19:36:22.000000,2025-05-16 14:14:27,5460,31.0,,,,,,9,,,,,,Graphics Processing Units Molecular Dynamics.,,,49.0,,,,,,,,,,,9,True,others,3.0, +23,dpti,deepmodeling/dpti,dpti,,,,https://github.com/deepmodeling/dpti,https://github.com/deepmodeling/dpti,LGPL-3.0,2021-04-04 13:57:37,2025-08-04 20:23:33.000000,2025-03-15 19:50:12,432,,19.0,6.0,81.0,9.0,1.0,29,,,,,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,2.0,2.0,17.0,https://pypi.org/project/dpti,,,,,,,,,,8,True,others,3.0, +24,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,,19.0,5.0,2.0,,1.0,92,,,,24.0,,,,,3.0,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,1071.0,7,True,others,3.0, +25,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,,2.0,1.0,1.0,,,6,,,,,,Finite Element Analysis Library in Python.,,,69.0,https://pypi.org/project/fealpy,,,,,,,,,,7,True,others,3.0,-3.0 +26,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,,12.0,9.0,25.0,4.0,,3,,,,,,,15.0,15.0,4.0,https://pypi.org/project/fpop,,,,,,,,,,7,True,others,3.0, +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,,23.0,5.0,67.0,,3.0,15,,,,,,Tutorials for DeepModeling projects.,,,11.0,,,,,,,,,,,6,True,others,3.0, +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,,5.0,9.0,2.0,3.0,,11,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10.0,,,,,,,,,,,6,True,others,3.0, +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,,7.0,5.0,24.0,,,3,,,,,,The home page of DeepModeling documentation.,,,8.0,,,,,,,,,,,6,True,others,3.0, +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,,15.0,9.0,29.0,,1.0,97,,,,,,AI for Science.,,,5.0,,,,,,,,,,,5,True,others,3.0, +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 23:30:28,63,2.0,3.0,2.0,,,,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,3.0, +32,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,,6.0,2.0,2.0,4.0,2.0,12,,,,,,Deep neural networks for density functional theory Hamiltonian.,,,6.0,,,,,,,,,,,4,True,others,3.0, +33,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,,7.0,5.0,13.0,,,6,,,,,,,,,4.0,,,,,,,,,,,4,True,others,3.0, +34,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,,3.0,1.0,6.0,,,4,,,,,,Automatic Differentiation Multipole Moment Molecular Forcefield.,,,7.0,,,,,,,,,,,4,True,others,3.0, +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,,1.0,2.0,1.0,2.0,1.0,6,,,,,,,,,3.0,,,,,,,,,,,2,True,others,3.0, +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,,1.0,1.0,1.0,,,1,,,,,,,,,2.0,,,,,,,,,,,0,True,others,, +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,,2.0,4.0,1.0,,1.0,1,,,,,,,,,2.0,,,,,,,,,,,-1,True,others,3.0, diff --git a/latest-changes.md b/latest-changes.md index d666d25..08dca12 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,16 +2,15 @@ _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._ -- DeePKS-kit (🥉9 · ⭐ 110 · 📈) - a package for developing machine learning-based chemically accurate energy and density functional models. LGPL-3.0 -- AIS-Square (🥉9 · ⭐ 13 · 📈) - LGPL-3.0 +- dpdispatcher (🥈22 · ⭐ 51 · 📈) - generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish. 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 (🥈15 · ⭐ 40 · 📉) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- deepmodeling_sphinx (🥉12 · ⭐ 3 · 📉) - Sphinx extension for DeepModeling projects. LGPL-3.0 -- rid-kit (🥉11 · ⭐ 49 · 📉) - Reinforced dynamics. LGPL-3.0 -- fealpy (🥉10 · ⭐ 6 · 📉) - Finite Element Analysis Library in Python. Unlicensed -- args (🥉10 · ⭐ 2 · 📉) - DeepModeling dargs arguments generation. LGPL-3.0 +- DeePTB (🥈16 · ⭐ 83 · 📉) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 +- dargs (🥈15 · ⭐ 6 · 💤) - Argument processing for the deep modeling project. LGPL-3.0 +- APEX (🥈12 · ⭐ 37 · 📉) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +- DP-GUI (🥉10 · ⭐ 8 · 📉) - A web-based GUI for user inputs. LGPL-3.0 +- fealpy (🥉7 · ⭐ 6 · 📉) - Finite Element Analysis Library in Python. Unlicensed