From 680966f8ff79b755f928e6cd1fda2921796d113f Mon Sep 17 00:00:00 2001 From: njzjz <9496702+njzjz@users.noreply.github.com> Date: Thu, 7 May 2026 18:34:12 +0000 Subject: [PATCH] Update best-of list for version 2026.05.07 --- README.md | 198 ++++++++++++++++---------------- history/2026-05-07_changes.md | 19 +++ history/2026-05-07_projects.csv | 39 +++++++ latest-changes.md | 15 ++- 4 files changed, 166 insertions(+), 105 deletions(-) create mode 100644 history/2026-05-07_changes.md create mode 100644 history/2026-05-07_projects.csv diff --git a/README.md b/README.md index e4ad533..b6ba8dc 100644 --- a/README.md +++ b/README.md @@ -44,14 +44,14 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K Back to top -
DeePMD-kit (🥇27 · ⭐ 1.9K · 📉) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 +
DeePMD-kit (🥇30 · ⭐ 1.9K · 📈) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 84 · 🔀 580 · 📥 69K · 📋 1K - 10% open · ⏱️ 08.04.2026): +- [GitHub](https://github.com/deepmodeling/deepmd-kit) (👨‍💻 84 · 🔀 580 · 📥 71K · 📦 49 · 📋 1K - 10% open · ⏱️ 07.05.2026): ``` git clone https://github.com/deepmodeling/deepmd-kit ``` -- [PyPi](https://pypi.org/project/deepmd-kit) (📥 7.1K / month): +- [PyPi](https://pypi.org/project/deepmd-kit) (📥 10K / month): ``` pip install deepmd-kit ``` @@ -59,59 +59,59 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K ``` 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) (📥 40 / month): ``` npm install deepmd-kit ``` -- [Docker Hub](https://hub.docker.com/r/deepmodeling/deepmd-kit) (📥 5.4K · ⭐ 1 · ⏱️ 05.04.2026): +- [Docker Hub](https://hub.docker.com/r/deepmodeling/deepmd-kit) (📥 5.6K · ⭐ 1 · ⏱️ 05.04.2026): ``` docker pull deepmodeling/deepmd-kit ```
-
dpdata (🥇27 · ⭐ 240 · 📈) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 +
ABACUS (🥇26 · ⭐ 260 · 📈) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 67 · 🔀 150 · 📦 160 · 📋 140 - 20% open · ⏱️ 06.04.2026): +- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 150 · 🔀 220 · 📋 2.6K - 7% open · ⏱️ 07.05.2026): ``` - git clone https://github.com/deepmodeling/dpdata + git clone https://github.com/deepmodeling/abacus-develop ``` -- [PyPi](https://pypi.org/project/dpdata) (📥 72K / month): +- [Conda](https://anaconda.org/conda-forge/abacus) (📥 650K · ⏱️ 20.12.2025): ``` - pip install dpdata + conda install -c conda-forge abacus ``` -- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 120K · ⏱️ 01.03.2026): +
+
dpdata (🥇26 · ⭐ 250 · 📉) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 + +- [GitHub](https://github.com/deepmodeling/dpdata) (👨‍💻 68 · 🔀 150 · 📦 160 · 📋 140 - 18% open · ⏱️ 07.05.2026): + ``` - conda install -c conda-forge dpdata + git clone https://github.com/deepmodeling/dpdata ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/dpdata) (📥 730 · ⏱️ 02.06.2023): +- [PyPi](https://pypi.org/project/dpdata) (📥 59K / month): ``` - docker pull dptechnology/dpdata + pip install dpdata ``` -
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ABACUS (🥇25 · ⭐ 260) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 - -- [GitHub](https://github.com/deepmodeling/abacus-develop) (👨‍💻 150 · 🔀 220 · 📋 2.5K - 7% open · ⏱️ 09.04.2026): - +- [Conda](https://anaconda.org/conda-forge/dpdata) (📥 130K · ⏱️ 01.03.2026): ``` - git clone https://github.com/deepmodeling/abacus-develop + conda install -c conda-forge dpdata ``` -- [Conda](https://anaconda.org/conda-forge/abacus) (📥 630K · ⏱️ 20.12.2025): +- [Docker Hub](https://hub.docker.com/r/dptechnology/dpdata) (📥 740 · ⏱️ 02.06.2023): ``` - conda install -c conda-forge abacus + docker pull dptechnology/dpdata ```
dpdispatcher (🥇23 · ⭐ 57) - 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) (👨‍💻 49 · 🔀 58 · 📦 70 · 📋 99 - 19% open · ⏱️ 29.03.2026): +- [GitHub](https://github.com/deepmodeling/dpdispatcher) (👨‍💻 49 · 🔀 58 · 📦 70 · 📋 100 - 20% open · ⏱️ 10.04.2026): ``` git clone https://github.com/deepmodeling/dpdispatcher ``` -- [PyPi](https://pypi.org/project/dpdispatcher) (📥 2.8K / month): +- [PyPi](https://pypi.org/project/dpdispatcher) (📥 3.8K / month): ``` pip install dpdispatcher ``` -- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 42K · ⏱️ 25.02.2026): +- [Conda](https://anaconda.org/conda-forge/dpdispatcher) (📥 44K · ⏱️ 25.02.2026): ``` conda install -c conda-forge dpdispatcher ``` @@ -120,65 +120,57 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K docker pull dptechnology/dpdispatcher ```
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DP-GEN (🥈22 · ⭐ 380 · 📉) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field. LGPL-3.0 +
DP-GEN (🥈22 · ⭐ 390) - 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 · 📥 2.1K · 📋 340 - 11% open · ⏱️ 06.04.2026): +- [GitHub](https://github.com/deepmodeling/dpgen) (👨‍💻 73 · 🔀 180 · 📥 2.1K · 📦 8 · 📋 340 - 11% open · ⏱️ 15.04.2026): ``` git clone https://github.com/deepmodeling/dpgen ``` -- [PyPi](https://pypi.org/project/dpgen) (📥 660 / month): +- [PyPi](https://pypi.org/project/dpgen) (📥 520 / month): ``` pip install dpgen ``` -- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 50K · ⏱️ 07.08.2025): +- [Conda](https://anaconda.org/conda-forge/dpgen) (📥 51K · ⏱️ 07.08.2025): ``` conda install -c conda-forge dpgen ```
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reacnetgenerator (🥈20 · ⭐ 97) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 +
reacnetgenerator (🥈20 · ⭐ 98) - an automatic reaction network generator for reactive molecular dynamics simulation. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/reacnetgenerator) (👨‍💻 19 · 🔀 46 · 📦 3 · 📋 130 - 6% open · ⏱️ 15.03.2026): ``` git clone https://github.com/deepmodeling/reacnetgenerator ``` -- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 2.5K / month): +- [PyPi](https://pypi.org/project/reacnetgenerator) (📥 780 / month): ``` pip install reacnetgenerator ``` -- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 760K · ⏱️ 11.11.2025): +- [Conda](https://anaconda.org/conda-forge/reacnetgenerator) (📥 770K · ⏱️ 11.11.2025): ``` conda install -c conda-forge reacnetgenerator ```
-
dargs (🥈18 · ⭐ 6) - Argument processing for the deep modeling project. LGPL-3.0 +
dargs (🥈18 · ⭐ 7) - Argument processing for the deep modeling project. LGPL-3.0 - [GitHub](https://github.com/deepmodeling/dargs) (👨‍💻 8 · 🔀 4 · 📦 160 · 📋 14 - 21% open · ⏱️ 24.02.2026): ``` git clone https://github.com/deepmodeling/dargs ``` -- [PyPi](https://pypi.org/project/dargs) (📥 80K / month): +- [PyPi](https://pypi.org/project/dargs) (📥 67K / month): ``` pip install dargs ``` -- [Conda](https://anaconda.org/conda-forge/dargs) (📥 63K · ⏱️ 25.02.2026): +- [Conda](https://anaconda.org/conda-forge/dargs) (📥 65K · ⏱️ 25.02.2026): ``` conda install -c conda-forge dargs ```
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DeepFlame (🥈17 · ⭐ 210) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 - -- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 30 · 🔀 75 · 📋 63 - 41% open · ⏱️ 14.02.2026): - - ``` - git clone https://github.com/deepmodeling/deepflame-dev - ``` -
dflow (🥈17 · ⭐ 81) - Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows).. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 23 · 🔀 29 · 📋 36 - 36% open · ⏱️ 21.01.2026): +- [GitHub](https://github.com/deepmodeling/dflow) (👨‍💻 23 · 🔀 30 · 📋 36 - 36% open · ⏱️ 21.01.2026): ``` git clone https://github.com/deepmodeling/dflow @@ -196,14 +188,34 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K docker pull dptechnology/dflow ```
+
JAX-FEM (🥈16 · ⭐ 660 · 📈) - Differentiable Finite Element Method with JAX. GPL-3.0 + +- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 17 · 🔀 120 · 📦 4 · 📋 73 - 27% open · ⏱️ 05.05.2026): + + ``` + git clone https://github.com/deepmodeling/jax-fem + ``` +- [PyPi](https://pypi.org/project/jax-fem) (📥 830 / month): + ``` + pip install jax-fem + ``` +
+
DeepFlame (🥈16 · ⭐ 210 · 📉) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 + +- [GitHub](https://github.com/deepmodeling/deepflame-dev) (👨‍💻 30 · 🔀 77 · 📋 63 - 41% open · ⏱️ 14.02.2026): + + ``` + git clone https://github.com/deepmodeling/deepflame-dev + ``` +
DPGEN2 (🥈16 · ⭐ 40) - 2nd generation of the Deep Potential GENerator. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 19 · 🔀 36 · 📦 6 · 📋 46 - 39% open · ⏱️ 04.04.2026): +- [GitHub](https://github.com/deepmodeling/dpgen2) (👨‍💻 19 · 🔀 36 · 📦 6 · 📋 46 - 39% open · ⏱️ 06.05.2026): ``` git clone https://github.com/deepmodeling/dpgen2 ``` -- [PyPi](https://pypi.org/project/dpgen2) (📥 94 / month): +- [PyPi](https://pypi.org/project/dpgen2) (📥 66 / month): ``` pip install dpgen2 ``` @@ -219,55 +231,43 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K ``` git clone https://github.com/deepmodeling/APEX ``` -- [PyPi](https://pypi.org/project/apex-flow) (📥 150 / month): +- [PyPi](https://pypi.org/project/apex-flow) (📥 160 / month): ``` pip install apex-flow ```
-
DP-GUI (🥈15 · ⭐ 9 · 💤) - 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) (📥 68K / month): - ``` - pip install dpgui - ``` -
-
JAX-FEM (🥈14 · ⭐ 640) - Differentiable Finite Element Method with JAX. GPL-3.0 +
DeePTB (🥈14 · ⭐ 110) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/jax-fem) (👨‍💻 17 · 🔀 110 · 📦 3 · 📋 71 - 35% open · ⏱️ 08.02.2026): +- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 15 · 🔀 30 · 📦 4 · 📋 62 - 35% open · ⏱️ 05.05.2026): ``` - git clone https://github.com/deepmodeling/jax-fem + git clone https://github.com/deepmodeling/DeePTB ``` -- [PyPi](https://pypi.org/project/jax-fem) (📥 620 / month): +- [PyPi](https://pypi.org/project/dptb) (📥 140 / month): ``` - pip install jax-fem + pip install dptb ```
-
DeePTB (🥈14 · ⭐ 100 · 📉) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 +
DP-GUI (🥈14 · ⭐ 9 · 💤) - A web-based GUI for user inputs. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DeePTB) (👨‍💻 15 · 🔀 29 · 📦 4 · 📋 60 - 33% open · ⏱️ 19.03.2026): +- [GitHub](https://github.com/deepmodeling/dpgui) (👨‍💻 4 · 🔀 5 · 📦 13 · ⏱️ 26.08.2025): ``` - git clone https://github.com/deepmodeling/DeePTB + git clone https://github.com/deepmodeling/dpgui ``` -- [PyPi](https://pypi.org/project/dptb) (📥 140 / month): +- [PyPi](https://pypi.org/project/dpgui) (📥 52K / month): ``` - pip install dptb + pip install dpgui ```
DMFF (🥈13 · ⭐ 190) - DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable.. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 17 · 🔀 46 · 📋 28 - 28% open · ⏱️ 07.04.2026): +- [GitHub](https://github.com/deepmodeling/DMFF) (👨‍💻 17 · 🔀 48 · 📋 28 - 28% open · ⏱️ 07.04.2026): ``` git clone https://github.com/deepmodeling/DMFF ``` -- [Conda](https://anaconda.org/conda-forge/dmff) (📥 3.1K · ⏱️ 22.04.2025): +- [Conda](https://anaconda.org/conda-forge/dmff) (📥 3.2K · ⏱️ 22.04.2025): ``` conda install -c conda-forge dmff ``` @@ -279,12 +279,12 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K ``` git clone https://github.com/deepmodeling/rid-kit ``` -- [PyPi](https://pypi.org/project/rid-kit) (📥 58 / month): +- [PyPi](https://pypi.org/project/rid-kit) (📥 68 / month): ``` pip install rid-kit ```
-
GPUMD (🥉12 · ⭐ 12) - Graphics Processing Units Molecular Dynamics. GPL-3.0 +
GPUMD (🥉12 · ⭐ 13) - Graphics Processing Units Molecular Dynamics. GPL-3.0 - [GitHub](https://github.com/deepmodeling/GPUMD) (👨‍💻 57 · ⏱️ 27.03.2026): @@ -292,28 +292,28 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K git clone https://github.com/deepmodeling/GPUMD ```
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deepmodeling_sphinx (🥉12 · ⭐ 3) - Sphinx extension for DeepModeling projects. LGPL-3.0 +
dpti (🥉11 · ⭐ 36 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 8 · 🔀 6 · ⏱️ 12.11.2025): +- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 17 · 🔀 23 · 📦 2 · 📋 10 - 90% open · ⏱️ 06.05.2026): ``` - git clone https://github.com/deepmodeling/deepmodeling_sphinx + git clone https://github.com/deepmodeling/dpti ``` -- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 2.4K / month): +- [PyPi](https://pypi.org/project/dpti) (📥 23 / month): ``` - pip install deepmodeling_sphinx + pip install dpti ```
-
dpti (🥉10 · ⭐ 35 · 💤) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. LGPL-3.0 +
deepmodeling_sphinx (🥉11 · ⭐ 3 · 📉) - Sphinx extension for DeepModeling projects. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/dpti) (👨‍💻 17 · 🔀 23 · 📦 2 · 📋 10 - 90% open · ⏱️ 15.03.2025): +- [GitHub](https://github.com/deepmodeling/deepmodeling_sphinx) (👨‍💻 8 · 🔀 6 · ⏱️ 12.11.2025): ``` - git clone https://github.com/deepmodeling/dpti + git clone https://github.com/deepmodeling/deepmodeling_sphinx ``` -- [PyPi](https://pypi.org/project/dpti) (📥 25 / month): +- [PyPi](https://pypi.org/project/deepmodeling_sphinx) (📥 5.4K / month): ``` - pip install dpti + pip install deepmodeling_sphinx ```
fealpy (🥉10 · ⭐ 6 · 💤) - Finite Element Analysis Library in Python. Unlicensed @@ -323,7 +323,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K ``` git clone https://github.com/deepmodeling/fealpy ``` -- [PyPi](https://pypi.org/project/fealpy) (📥 450 / month): +- [PyPi](https://pypi.org/project/fealpy) (📥 210 / month): ``` pip install fealpy ``` @@ -343,7 +343,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K ``` git clone https://github.com/deepmodeling/fpop ``` -- [PyPi](https://pypi.org/project/fpop) (📥 340 / month): +- [PyPi](https://pypi.org/project/fpop) (📥 190 / month): ``` pip install fpop ``` @@ -355,25 +355,29 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K ``` git clone https://github.com/deepmodeling/args ``` -- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 32 / month): +- [npm](https://www.npmjs.com/package/@deepmodeling/args) (📥 97 / month): ``` npm install @deepmodeling/args ```
AIS-Square (🥉8 · ⭐ 15) - LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 8 · 📋 6 - 83% open · ⏱️ 03.04.2026): +- [GitHub](https://github.com/deepmodeling/AIS-Square) (👨‍💻 8 · 🔀 9 · 📋 6 - 83% open · ⏱️ 04.05.2026): ``` git clone https://github.com/deepmodeling/AIS-Square ```
-
Blog (🥉8 · ⭐ 3) - DeepModeling Blog. LGPL-3.0 +
Uni-Fold (🥉7 · ⭐ 94 · 💤) - Apache-2 -- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 11 · 🔀 10 · ⏱️ 04.02.2026): +- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 19 · ⏱️ 18.08.2022): ``` - git clone https://github.com/deepmodeling/blog + git clone https://github.com/deepmodeling/Uni-Fold + ``` +- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 1.6K · ⏱️ 08.01.2024): + ``` + docker pull dptechnology/unifold ```
community (🥉7 · ⭐ 93) - DeepModeling community content. Unlicensed @@ -384,19 +388,15 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K git clone https://github.com/deepmodeling/community ```
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Uni-Fold (🥉7 · ⭐ 93 · 💤) - Apache-2 +
Blog (🥉7 · ⭐ 3 · 📉) - DeepModeling Blog. LGPL-3.0 -- [GitHub](https://github.com/deepmodeling/Uni-Fold) (👨‍💻 3 · 🔀 19 · ⏱️ 18.08.2022): +- [GitHub](https://github.com/deepmodeling/blog) (👨‍💻 11 · 🔀 9 · ⏱️ 04.02.2026): ``` - git clone https://github.com/deepmodeling/Uni-Fold - ``` -- [Docker Hub](https://hub.docker.com/r/dptechnology/unifold) (📥 1.5K · ⏱️ 08.01.2024): - ``` - docker pull dptechnology/unifold + git clone https://github.com/deepmodeling/blog ```
-
tbplas (🥉6 · ⭐ 17 · 💤) - Repository of TBPLaS (tight-binding package for large-scale simulation). Unlicensed +
tbplas (🥉6 · ⭐ 18 · 💤) - Repository of TBPLaS (tight-binding package for large-scale simulation). Unlicensed - [GitHub](https://github.com/deepmodeling/tbplas) (👨‍💻 10 · 🔀 6 · ⏱️ 17.01.2024): @@ -444,7 +444,7 @@ This curated list contains 38 awesome open-source projects with a total of 4.9K git clone https://github.com/deepmodeling/DeepH-pack ```
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DeePDih (🥉4 · ⭐ 6 · 📉) - Deep Potential driven molecular dihedral scan toolkit. MIT +
DeePDih (🥉4 · ⭐ 6) - Deep Potential driven molecular dihedral scan toolkit. MIT - [GitHub](https://github.com/deepmodeling/DeePDih) (👨‍💻 2 · 🔀 3 · 📥 7 · ⏱️ 07.04.2026): diff --git a/history/2026-05-07_changes.md b/history/2026-05-07_changes.md new file mode 100644 index 0000000..18de219 --- /dev/null +++ b/history/2026-05-07_changes.md @@ -0,0 +1,19 @@ +## 📈 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._ + +- DeePMD-kit (🥇30 · ⭐ 1.9K · 📈) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 +- ABACUS (🥇26 · ⭐ 260 · 📈) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 +- JAX-FEM (🥈16 · ⭐ 660 · 📈) - Differentiable Finite Element Method with JAX. GPL-3.0 +- dpti (🥉11 · ⭐ 36 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. 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._ + +- dpdata (🥇26 · ⭐ 250 · 📉) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 +- DeepFlame (🥈16 · ⭐ 210 · 📉) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 +- DP-GUI (🥈14 · ⭐ 9 · 💤) - A web-based GUI for user inputs. LGPL-3.0 +- deepmodeling_sphinx (🥉11 · ⭐ 3 · 📉) - Sphinx extension for DeepModeling projects. LGPL-3.0 +- Blog (🥉7 · ⭐ 3 · 📉) - DeepModeling Blog. LGPL-3.0 + diff --git a/history/2026-05-07_projects.csv b/history/2026-05-07_projects.csv new file mode 100644 index 0000000..4c2bf5e --- /dev/null +++ b/history/2026-05-07_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,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 15:23:44,2026-05-07 06:40:42.000000,2026-05-07 02:31:50,3668,150.0,583.0,45.0,2846.0,105.0,900.0,1924,2026-03-19 09:37:17,3.1.3,70578.0,55975.0,61.0,A deep learning package for many-body potential energy representation and molecular dynamics.,49.0,49.0,84,https://pypi.org/project/deepmd-kit,10327.0,https://anaconda.org/conda-forge/deepmd-kit,2026-03-19 16:01:57.130,2723615.0,https://www.npmjs.com/package/deepmd-kit,40.0,https://hub.docker.com/r/deepmodeling/deepmd-kit,2026-04-05 16:50:48.621287,1.0,5561.0,30,True,others,1,3.0 +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 04:04:52,2026-05-07 13:47:17.000000,2026-05-07 13:47:16,7795,161.0,224.0,9.0,4589.0,188.0,2369.0,262,2026-04-19 03:25:22,3.11.0-beta.1,,19096.0,93.0,An electronic structure package based on either plane wave basis or numerical atomic orbitals.,,,148,,,https://anaconda.org/conda-forge/abacus,2025-12-20 09:51:19.492,649285.0,,,,,,,26,True,others,1,1.0 +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 13:24:23,2026-05-07 13:32:49.000000,2026-05-07 13:13:34,934,29.0,152.0,5.0,682.0,26.0,111.0,247,2026-05-07 13:32:49,1.0.2,,60858.0,43.0,A Python package for manipulating atomistic data of software in computational science.,158.0,158.0,68,https://pypi.org/project/dpdata,59022.0,https://anaconda.org/conda-forge/dpdata,2026-03-01 02:16:08.681,126145.0,,,https://hub.docker.com/r/dptechnology/dpdata,2023-06-02 09:30:14.674068,,739.0,26,True,others,1,-1.0 +3,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 05:14:37,2026-04-27 20:57:43.000000,2026-04-10 01:35:40,1157,23.0,58.0,4.0,469.0,20.0,80.0,57,2026-03-29 17:31:30,1.0.3,,7098.0,56.0,generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish.,70.0,70.0,49,https://pypi.org/project/dpdispatcher,3824.0,https://anaconda.org/conda-forge/dpdispatcher,2026-02-25 23:31:49.645,43620.0,,,https://hub.docker.com/r/dptechnology/dpdispatcher,2026-03-29 17:36:27.626936,,148414.0,23,True,others,1, +4,DP-GEN,deepmodeling/dpgen,dpgen,conda-forge/dpgen,,,https://github.com/deepmodeling/dpgen,https://github.com/deepmodeling/dpgen,LGPL-3.0,2019-06-13 11:43:56,2026-04-15 05:06:55.000000,2026-04-15 05:06:55,2243,8.0,185.0,10.0,959.0,38.0,299.0,386,2025-08-07 07:42:12,0.13.2,2098.0,1268.0,21.0,The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field.,8.0,8.0,73,https://pypi.org/project/dpgen,518.0,https://anaconda.org/conda-forge/dpgen,2025-08-07 18:05:24.933,51420.0,,,,,,,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 15:07:56,2026-04-27 20:58:13.000000,2026-03-15 12:44:13,2560,12.0,46.0,5.0,2276.0,8.0,124.0,98,2025-01-05 07:30:15,1.6.15,,11518.0,100.0,an automatic reaction network generator for reactive molecular dynamics simulation.,3.0,3.0,19,https://pypi.org/project/reacnetgenerator,778.0,https://anaconda.org/conda-forge/reacnetgenerator,2025-11-11 16:14:11.843,773305.0,,,,,,,20,True,others,2, +6,dargs,deepmodeling/dargs,dargs,conda-forge/dargs,,,https://github.com/deepmodeling/dargs,https://github.com/deepmodeling/dargs,LGPL-3.0,2020-09-19 22:20:28,2026-04-27 20:57:34.000000,2026-02-24 10:51:44,175,9.0,4.0,4.0,96.0,3.0,11.0,7,2026-02-24 10:55:05,0.5.0.post0,,68517.0,34.0,Argument processing for the deep modeling project.,158.0,158.0,8,https://pypi.org/project/dargs,67452.0,https://anaconda.org/conda-forge/dargs,2026-02-25 05:33:17.014,64997.0,,,,,,,18,True,others,2, +7,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 08:14:36,2026-01-21 07:08:16.591515,2026-01-21 07:05:50,2277,,30.0,,914.0,13.0,23.0,81,2026-01-21 07:06:16,1.8.133,,355.0,100.0,Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows)..,,,23,https://pypi.org/project/dflow,,https://anaconda.org/conda-forge/dflow,,,,,https://hub.docker.com/r/dptechnology/dflow,2026-01-21 07:08:16.591515,,18499.0,17,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 15:20:54,2026-05-05 07:33:30.000000,2026-05-05 07:32:27,287,14.0,117.0,13.0,14.0,20.0,53.0,662,,,,828.0,,Differentiable Finite Element Method with JAX.,4.0,4.0,17,https://pypi.org/project/jax-fem,828.0,,,,,,,,,,16,True,others,2,2.0 +9,DeepFlame,deepmodeling/deepflame-dev,,,,,https://github.com/deepmodeling/deepflame-dev,https://github.com/deepmodeling/deepflame-dev,GPL-3.0,2022-06-12 10:25:12,2026-05-07 02:45:56.000000,2026-02-14 09:11:59,1181,1.0,77.0,6.0,515.0,26.0,37.0,211,2026-01-28 10:56:30,2.0.0,,,23.0,A deep learning empowered open-source platform for reacting flow simulations.,,,30,,,,,,,,,,,,16,True,others,2,-1.0 +10,DPGEN2,deepmodeling/dpgen2,dpgen2,,,dptechnology/dpgen2,https://github.com/deepmodeling/dpgen2,https://github.com/deepmodeling/dpgen2,LGPL-3.0,2022-02-28 02:41:16,2026-05-06 03:52:59.000000,2026-05-06 03:52:52,358,9.0,36.0,5.0,282.0,18.0,28.0,40,2023-01-28 03:43:25,0.0.7,,155.0,7.0,2nd generation of the Deep Potential GENerator.,6.0,6.0,19,https://pypi.org/project/dpgen2,66.0,,,,,,https://hub.docker.com/r/dptechnology/dpgen2,2026-03-11 00:37:13.302433,,4543.0,16,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 06:13:42,2026-03-30 02:53:36.000000,2025-04-10 13:16:14,621,,27.0,6.0,90.0,1.0,9.0,45,2024-05-06 10:01:52,1.2.0,,158.0,4.0,APEX: Alloy Properties EXplorer using simulations.,4.0,4.0,7,https://pypi.org/project/apex-flow,158.0,,,,,,,,,,15,True,others,2, +12,DeePTB,deepmodeling/DeePTB,dptb,,,,https://github.com/deepmodeling/DeePTB,https://github.com/deepmodeling/DeePTB,LGPL-3.0,2023-07-11 03:19:42,2026-05-05 14:39:28.000000,2026-05-05 14:38:25,841,8.0,30.0,2.0,258.0,22.0,40.0,112,2025-05-07 14:02:40,2.2.0,,138.0,12.0,DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy.,4.0,4.0,15,https://pypi.org/project/dptb,138.0,,,,,,,,,,14,True,others,2, +13,DP-GUI,deepmodeling/dpgui,dpgui,,,,https://github.com/deepmodeling/dpgui,https://github.com/deepmodeling/dpgui,LGPL-3.0,2021-07-21 18:48:23,2026-04-27 20:57:42.000000,2025-08-26 11:26:26,326,,5.0,5.0,554.0,,1.0,9,2024-11-17 07:05:49,1.0.1.post0,,52134.0,5.0,A web-based GUI for user inputs.,13.0,13.0,4,https://pypi.org/project/dpgui,52134.0,,,,,,,,,,14,True,others,2,-1.0 +14,DMFF,deepmodeling/DMFF,,conda-forge/dmff,,,https://github.com/deepmodeling/DMFF,https://github.com/deepmodeling/DMFF,LGPL-3.0,2022-02-14 01:35:50,2026-04-07 01:20:04.000000,2026-04-07 00:52:04,441,1.0,48.0,8.0,182.0,8.0,20.0,193,2023-11-09 14:32:37,1.0.0,,115.0,4.0,DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable..,,,17,,,https://anaconda.org/conda-forge/dmff,2025-04-22 14:58:55.028,3230.0,,,,,,,13,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,,25.0,3.0,21.0,2.0,3.0,52,2024-05-14 03:25:35,0.6.4,148.0,70.0,5.0,Reinforced dynamics.,2.0,2.0,14,https://pypi.org/project/rid-kit,68.0,,,,,,,,,,12,True,others,3, +16,GPUMD,deepmodeling/GPUMD,,,,,https://github.com/deepmodeling/GPUMD,https://github.com/deepmodeling/GPUMD,GPL-3.0,2024-06-18 05:40:21,2026-03-27 13:37:03.000000,2026-03-27 13:33:25,6511,223.0,,,,,,13,,,,,,Graphics Processing Units Molecular Dynamics.,,,57,,,,,,,,,,,,12,True,others,3, +17,dpti,deepmodeling/dpti,dpti,,,,https://github.com/deepmodeling/dpti,https://github.com/deepmodeling/dpti,LGPL-3.0,2021-04-04 13:57:37,2026-05-06 08:52:09.000000,2026-05-06 08:52:09,442,10.0,23.0,5.0,99.0,9.0,1.0,36,,,,23.0,,A Python Package to Automate Thermodynamic Integration Calculations for Free Energy.,2.0,2.0,17,https://pypi.org/project/dpti,23.0,,,,,,,,,,11,True,others,3,1.0 +18,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 00:19:06,2026-04-27 20:57:36.000000,2025-11-12 10:16:02,81,,6.0,4.0,75.0,,1.0,3,2025-11-12 10:16:41,0.3.2,,5397.0,26.0,Sphinx extension for DeepModeling projects.,,,8,https://pypi.org/project/deepmodeling_sphinx,5397.0,,,,,,,,,,11,True,others,3,-1.0 +19,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,,,,207.0,,Finite Element Analysis Library in Python.,,,69,https://pypi.org/project/fealpy,207.0,,,,,,,,,,10,True,others,3, +20,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,,36.0,12.0,47.0,14.0,17.0,118,,,,,,a package for developing machine learning-based chemically accurate energy and density functional models.,,,7,,,,,,,,,,,,9,True,others,3, +21,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,,12.0,8.0,26.0,4.0,,3,,,,192.0,,,15.0,15.0,4,https://pypi.org/project/fpop,192.0,,,,,,,,,,9,True,others,3, +22,args,deepmodeling/args,,,@deepmodeling/args,,https://github.com/deepmodeling/args,https://github.com/deepmodeling/args,LGPL-3.0,2021-12-27 03:27:24,2026-03-30 16:36:39.000000,2025-12-15 15:39:22,88,,2.0,4.0,73.0,,,2,2025-03-06 02:44:56,0.1.1,,97.0,18.0,DeepModeling dargs arguments generation.,5.0,5.0,3,,,,,,https://www.npmjs.com/package/@deepmodeling/args,97.0,,,,,9,True,others,3, +23,AIS-Square,deepmodeling/AIS-Square,,,,,https://github.com/deepmodeling/AIS-Square,https://github.com/deepmodeling/AIS-Square,LGPL-3.0,2022-09-13 09:52:30,2026-05-04 04:25:35.000000,2026-05-04 04:25:35,1288,22.0,9.0,7.0,211.0,5.0,1.0,15,,,,,,,,,8,,,,,,,,,,,,8,True,others,3, +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,,19.0,4.0,2.0,,1.0,94,,,,30.0,,,,,3,,,,,,,,https://hub.docker.com/r/dptechnology/unifold,2024-01-08 06:24:09.367953,,1604.0,7,True,others,3, +25,community,deepmodeling/community,,,,,https://github.com/deepmodeling/community,https://github.com/deepmodeling/community,,2021-05-06 04:50:02,2025-12-25 02:14:41.000000,2025-12-25 02:14:41,179,,24.0,9.0,56.0,,2.0,93,,,,,,DeepModeling community content.,,,20,,,,,,,,,,,,7,True,others,3, +26,Blog,deepmodeling/blog,,,,,https://github.com/deepmodeling/blog,https://github.com/deepmodeling/blog,LGPL-3.0,2021-06-10 23:11:55,2026-02-04 02:53:54.000000,2026-02-04 02:53:53,389,,9.0,5.0,342.0,,,3,,,,,,DeepModeling Blog.,,,11,,,,,,,,,,,,7,True,others,3,-1.0 +27,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,,18,2024-03-01 09:33:35,1.6,,,1.0,Repository of TBPLaS (tight-binding package for large-scale simulation).,,,10,,,,,,,,,,,,6,True,others,3, +28,tutorials,deepmodeling/tutorials,,,,,https://github.com/deepmodeling/tutorials,https://github.com/deepmodeling/tutorials,,2022-03-07 06:19:19,2026-03-11 03:01:34.000000,2026-03-11 02:48:33,147,1.0,24.0,4.0,72.0,1.0,3.0,16,,,,,,Tutorials for DeepModeling projects.,,,12,,,,,,,,,,,,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,,,,,,,,,,,,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,,16.0,8.0,29.0,,1.0,100,,,,,,AI for Science.,,,5,,,,,,,,,,,,5,True,others,3, +31,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,,,,,,,,,,,,5,True,others,3, +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,,6.0,1.0,2.0,4.0,2.0,14,,,,,,Deep neural networks for density functional theory Hamiltonian.,,,6,,,,,,,,,,,,4,True,others,3, +33,DeePDih,deepmodeling/DeePDih,,,,,https://github.com/deepmodeling/DeePDih,https://github.com/deepmodeling/DeePDih,MIT,2024-03-03 13:22:19,2026-04-07 09:18:59.000000,2026-04-07 09:18:53,65,2.0,3.0,2.0,,,,6,2024-12-21 09:53:32,dpa-2-gfn2-xtb-tblite,7.0,0.0,1.0,Deep Potential driven molecular dihedral scan toolkit.,,,2,,,,,,,,,,,,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,,8.0,4.0,14.0,,,6,,,,,,,,,4,,,,,,,,,,,,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,,,,,,,,,,,,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,,,,,,,,,,,,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,,,,,,,,,,,,-1,True,others,3, diff --git a/latest-changes.md b/latest-changes.md index f476623..18de219 100644 --- a/latest-changes.md +++ b/latest-changes.md @@ -2,15 +2,18 @@ _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._ -- dpdata (🥇27 · ⭐ 240 · 📈) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 -- APEX (🥈15 · ⭐ 45 · 💤) - APEX: Alloy Properties EXplorer using simulations. LGPL-3.0 +- DeePMD-kit (🥇30 · ⭐ 1.9K · 📈) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 +- ABACUS (🥇26 · ⭐ 260 · 📈) - An electronic structure package based on either plane wave basis or numerical atomic orbitals. LGPL-3.0 +- JAX-FEM (🥈16 · ⭐ 660 · 📈) - Differentiable Finite Element Method with JAX. GPL-3.0 +- dpti (🥉11 · ⭐ 36 · 📈) - A Python Package to Automate Thermodynamic Integration Calculations for Free Energy. 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._ -- DeePMD-kit (🥇27 · ⭐ 1.9K · 📉) - A deep learning package for many-body potential energy representation and molecular dynamics. LGPL-3.0 -- DP-GEN (🥈22 · ⭐ 380 · 📉) - The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field. LGPL-3.0 -- DeePTB (🥈14 · ⭐ 100 · 📉) - DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy. LGPL-3.0 -- DeePDih (🥉4 · ⭐ 6 · 📉) - Deep Potential driven molecular dihedral scan toolkit. MIT +- dpdata (🥇26 · ⭐ 250 · 📉) - A Python package for manipulating atomistic data of software in computational science. LGPL-3.0 +- DeepFlame (🥈16 · ⭐ 210 · 📉) - A deep learning empowered open-source platform for reacting flow simulations. GPL-3.0 +- DP-GUI (🥈14 · ⭐ 9 · 💤) - A web-based GUI for user inputs. LGPL-3.0 +- deepmodeling_sphinx (🥉11 · ⭐ 3 · 📉) - Sphinx extension for DeepModeling projects. LGPL-3.0 +- Blog (🥉7 · ⭐ 3 · 📉) - DeepModeling Blog. LGPL-3.0