Find open-source science resources

A directory of tools, AI models, datasets, and research resources for biotech, bioinformatics, and other scientific fields. Aggregated from curated GitHub awesome-lists, HuggingFace, bio.tools, Bioconductor, and more.

1,193 of 7,078 resources

Showing 601–650

Hulu-Med: A Transparent Generalist Model towards Holistic Medical Vision-Language Understanding

Active4724 months ago
Python

Highly scalable equivariant deep learning interatomic potentials enabling million-atom molecular dynamics simulations with ab initio accuracy, building on E(3)-equivariant architectures for large-scale atomistic modeling (mir-group, MIT License, 480+ stars)

Active4984 months ago
Python
MIT

Foundational auto-research agent framework for agentic science at scale, providing modular agent construction, run-level self-evolution, and multiple SciMaster domain agents (ML-Master, X-Master, Browse-Master); outperforms general-purpose agents across authoritative benchmarks including the OpenAI Frontier Science Benchmark (206+ stars, Apache 2.0, 2026)

Active2194 months ago
Python
Apache-2.0

Decentralized self-organizing teams of AI agents for long-running computational scientific experimentation; agents critique each other's proposals before spending compute and share successes/failures to avoid redundant exploration, achieving +8.33% on BioML-Bench, 1.9× faster nanoGPT optimization, and +12.5% on ProteinGym ACE2-Spike (425+ stars, 2026)

Active7634 months ago
Python

Generative foundation model for functional antibody and nanobody design, supporting de novo generation, affinity maturation, inverse design, structure prediction, and humanization (Tencent AI4S, ICLR 2025)

Active2324 months ago
Python
MIT

For a convenient overview and download list, visit our model page for this model.

Active5K4 months ago
Python

This set of model weights was released with the GitHub-compatible esm package format. The models here are kept for backwards compatibility, but we recommend you use the HuggingFace-compatible model weights at biohub/ESMC-6B (or biohub/ESMC-300M / biohub/ESMC-600M) instead.

Active6.2K4 months ago
Python
Active18.5K4 months ago
Python
Active954 months ago
Python

Generalized biological foundation model with unified nucleic acid and protein language, integrating DNA/RNA/protein sequences (Nature Machine Intelligence 2025)

Active3704 months ago
Python
Apache-2.0

Automates and standardizes ligand preparation for AutoDock Vina.

Active1904 months ago
Python
Apache-2.0

Modelo fine-tunado com LoRA (MLX / Apple Silicon) para assistência clínica em saúde da mulher.

Active1254 months ago
Python

3D vision-language model for computed tomography that leverages both structured electronic health records (EHR) and unstructured radiology reports for pretraining, enabling multimodal medical understanding and radiology report generation (447+ stars, MIT License, 2026)

Active4674 months ago
Python
MIT

Automated cell type annotation tool for single-cell transcriptomics using gradient boosting and logistic regression with reference atlases, enabling standardized classification across datasets (Wellcome Sanger Institute, Nature Biotechnology 2022)

Active5024 months ago
Python
MIT
Active824 months ago
Python

Automate downloading, opening, and parsing DrugBank.

Active694 months ago
Python
MIT

This is the pretrained VetBERT model from the github repo: https://github.com/havocy28/VetBERT

Active944 months ago
Python

DeepMind's neural network for ab-initio quantum chemistry, directly solving the many-electron Schrödinger equation via variational Monte Carlo with antisymmetric wavefunctions, extended to excited states (Phys. Rev. Research 2020, Science 2024)

Active8544 months ago
Python
Apache-2.0

A package for accessing data from the NIST webbook...

Active574 months ago
Python
MIT

Target-Conditioned Molecular Ideation Model for Drug Discovery Research

Active04 months ago
Python

Genos-m is a foundation model for human-associated microbial genomes. It is trained to model microbial DNA sequences at single-nucleotide resolution and supports ultra-long genomic contexts up to one million tokens.

Active314 months ago
Python

StatescopeR is an R wrapper around Statescope, a computational framework designed to discover cell states from cell type-specific gene expression profiles inferred from bulk RNA profiles.

Active04 months ago
Python
NOASSERTION

The Chromosome Ontology is an automatically derived ontology of chromosomes and chromosome parts.

Active154 months ago
Python

Qwen3-8B-syco_med-gated-attention-FT is a plug-and-play gated attention weight released for AI safety research.

Active04 months ago
Python

All-atom biomolecular structure prediction for protein-nucleic acid-small molecule-metal ion complexes, enabling accurate modeling of covalent modifications and assemblies beyond proteins (Baker Lab, Science 2024)

Active8214 months ago
Python
NOASSERTION

LoRA fine-tune of Qwen3.5-9B on synthetic clinical triage Q&A pairs generated from PubMed Central open-access papers. The model is specialized for emergency-medicine decision-making: triaging patients, applying clinical decision rules, and generating protocol-grounded triage recommendations.

Active04 months ago
Python

Parallel symbolic regression network evaluating millions of expressions on GPU with automated subtree reuse, Nature Computational Science cover article (MIT, 2026)

Active254 months ago
Python
MIT

Gemma 4 E2B fine-tuned on 225K drug–target pairs for novel small-molecule generation.

Active254 months ago
Python

Deployable biomedical deep-research agent blueprint combining on-prem multimodal RAG, report generation, human-in-the-loop editing, and virtual screening with MolMIM and DiffDock for drug discovery workflows (2025)

Active1444 months ago
Python
Apache-2.0

- 2025-05-15: We identified a bug in the Bacformer Large code on HuggingFace which resulted in a significant drop in the quality of the output embeddings. This is now fixed, but if you downloaded or cached the model before this date, re-download and use the latest model revision before running…

Active8K4 months ago
Python

- 2025-05-15: We identified a bug in the Bacformer Large code on HuggingFace which resulted in a significant drop in the quality of the output embeddings. This is now fixed, but if you downloaded or cached the model before this date, re-download and use the latest model revision before running…

Active5474 months ago
Python

General multimodal protein design framework enabling DNA-encoding of chemistry for programmable enzyme design and diverse protein generation through diffusion-based generative modeling (190+ stars, Apache 2.0, 2026)

Active2195 months ago
Python
Apache-2.0

For a convenient overview and download list, visit our model page for this model.

Active7035 months ago
Python

MIST is a family of molecular foundation models for molecular property prediction. The models were pre-trained on SMILES strings from the Enamine REAL Space dataset using the Masked Language Modeling (MLM) objective, then fine-tuned for downstream prediction tasks.

Active1475 months ago
Python

Open-source self-supervised vision foundation model for Earth observation by Clay Foundation (non-profit), a Masked Autoencoder ViT pretrained on multimodal satellite imagery (Sentinel-1/2, Landsat 8-9, NAIP, MODIS, LINZ DEM) with location/time embeddings, supporting classification, segmentation, change detection, similarity search, and few-shot downstream geospatial tasks (Apache 2.0, v1.5 2024-2025)

Active6135 months ago
Python
Apache-2.0

Fast, all-atom SE(3)-equivariant diffusion model for protein design achieving state-of-the-art performance on unconditional generation, motif scaffolding, and binder design while retaining the computational efficiency of equivariant architectures (bioRxiv 2026)

Active1355 months ago
Python
Apache-2.0

A patient-level disease classification model trained on single-cell RNA-seq data. Given a matrix of gene expression profiles (one row per cell), the model produces a disease-category prediction for the patient.

Active765 months ago
Python

MedPsy-4B is a state-of-the-art, text-only medical and healthcare language model purpose-built for edge deployment. Built on top of Qwen3-4B-Thinking-2507 and post-trained with a multi-stage pipeline (supervised fine-tuning + reinforcement learning) on curated medical data, it surpasses models…

Active1K5 months ago
Python

MedPsy-1.7B is a state-of-the-art, text-only medical and healthcare language model purpose-built for edge and smartphone deployment. Built on top of Qwen3-1.7B (operated in thinking mode, i.e. with enable_thinking=True) and post-trained with a multi-stage pipeline (supervised fine-tuning +…

Active6085 months ago
Python

Benchmark quantifying end-to-end autonomous AI research abilities of LLM agents across 20 tasks from SOTA machine learning papers spanning NLP, code, math, biochemical modelling, and time series forecasting, with normalized score metrics against human SOTA and HuggingFace dataset

Active1125 months ago
Python
NOASSERTION

General-purpose RNA language model with 650M parameters pretrained on 36M non-coding RNA sequences, achieving strong generalization on structure prediction tasks including secondary structure prediction, splice-site prediction, mean ribosome loading, and ncRNA classification (lbcb-sci, 165+ stars, Apache-2.0)

Active1735 months ago
Python
Apache-2.0

First physics-aligned interactive benchmark for LLM agents in engineering construction, designing rockets/cars/bridges in physics simulator with 3D spatial geometry library

Active985 months ago
Python
NOASSERTION

Simple RDKit molecule editor GUI using PySide.

Active1805 months ago
Python
LGPL-3.0

Semi-flexible molecular diffusion model for structure-based drug design with reinforcement learning, achieving 20× faster sampling and providing a no-code web platform for molecular design (ISPC Lab, Tongji University, 2026)

Active345 months ago
Python

Fast spike sorting with drift correction for extracellular electrophysiology, enabling universal neural spike sorting via deep learning on high-density neural probe recordings (MouseLand, 609+ stars)

Active6255 months ago
Python
GPL-3.0

## Introduction (简介) This model is a domain-specific expert fine-tuned from Qwen/Qwen2.5-7B-Instruct using LoRA (Low-Rank Adaptation). It is specifically designed for Fine-grained Information Extraction (IE) of technical indicator quintuples from highly complex lithium-ion battery patents.

Active105 months ago
Python

Trackastra is a transformer-based cell-tracking tool for live-cell microscopy. It links already segmented cell instances across time by predicting associations between detections. It supports greedy tracking with or without cell divisions, optional ILP-based linking, pretrained tracking models, and export of tracked masks and lineage information in Cell Tracking Challenge format.

Active05 months ago
Python
MIT