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Ai4science Python Packages

Python packages with the GitHub topic ai4science. Sorted by relevance, with stars and monthly downloads.
PaddlePaddle
paddleocr

Turn any PDF or image document into structured data for your AI. A powerful, lightweight OCR toolkit that bridges the gap between images/PDFs and LLMs. Supports 100+ languages.

2.2M 78K 10K
microsoft
mattersim

MatterSim: A deep learning atomistic model across elements, temperatures and pressures.

896K 551 82
opendatalab
mineru

Transforms complex documents like PDFs and Office docs into LLM-ready markdown/JSON for your Agentic workflows.

305K 64K 5K
Future-House
fhaviary

A language agent gym with challenging scientific tasks

142K 261 32
terrastackai
terratorch

A Python toolkit for fine-tuning Geospatial Foundation Models (GFMs).

97K 802 153
opendatalab
magic-pdf

Transforms complex documents like PDFs and Office docs into LLM-ready markdown/JSON for your Agentic workflows.

76K 64K 5K
bytedance
protenix

Toward High-Accuracy Open-Source Biomolecular Structure Prediction.

12K 2K 273
chaobrain
brainunit

Physical units and unit-aware mathematical system for general-purpose brain dynamics modeling.

8K 15 3
chaobrain
saiunit

Unit-aware Computations for AI-driven Scientific Computing.

7K 17 1
opendatalab
mineru-selfhosted-mcp

MCP bridge for a self-hosted MinerU API

5K 64K 5K
EvoScientist
evoscientist

🔬 Harness Vibe Research with Self-evolving AI Scientists

5K 3K 194
DLS5-Omics
multimolecule

Accelerate Molecular Biology Research with Machine Learning

3K 53 8
TrinitroCat
buctoolkit

Batch-upscaled Catalysis Toolkit

1K 5 1
chao1224
geom3d

Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023

759 130 15
ryannduma
crystalyse-ai

Intelligent Scientific Agent for Materials Design

735 24 4
iowarp
clio-agent

A science agent supporting any general AI agent in performing data management operations at scale. Builds upon the heritage of the IOWarp platform and proudly represents work done at Gnosis Research Center at Illinois Tech. Supported by NSF.

655 0 0
adosar
aidsorb

Python package for deep learning on molecular point clouds.

502 6 2
iowarp
clio-kit

Bringing AI practically to science!

498 24 25
PaddlePaddle
fadoudou2

Awesome OCR toolkits based on PaddlePaddle(8.6M ultra-lightweight pre-trained model, support training and deployment among server, mobile, embedded and IoT devices)

481 78K 10K
Kubenew
pdf2struct

`pdf2struct` extracts structured JSON from PDF documents.

392 1 0
IntelliGen-AI
intellifold

IntelliFold: A Controllable Foundation Model for General and Specialized Biomolecular Structure Prediction.

361 221 24
iowarp
iowarp-mcps

Bringing AI practically to science!

345 24 25
adosar
retnext

A lightweight package for deep learning on 3D energy images of porous materials

311 1 1
PaddlePaddle
paddleocrwordleveldetection

Awesome OCR toolkits based on PaddlePaddle (8.6M ultra-lightweight pre-trained model, support training and deployment among server, mobile, embeded and IoT devices

296 78K 10K
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