ChemFM
Research AI model / method · Research code or publication
Chemical foundation model for learned molecular representations, property prediction and conditional mole
Luo Lab
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Trouvez des modèles, des logiciels de recherche, des outils de support et du matériel. Utilisez des filtres pour le type d’entrée, le mode d’accès ou le rôle de l’IA.
36 produits correspondants · 36 produits sur la page 1. Les filtres s'appliquent à l'ensemble du catalogue.
Research AI model / method · Research code or publication
Chemical foundation model for learned molecular representations, property prediction and conditional mole
Luo Lab
Research AI model / method · Research code or publication
Diffusion-based ligand molecule generation constrained by specified pocket and pharmacophore interactions
Sekijima Lab
Classical/statistical scientific method · Confirm distribution and exact release
Rosetta macromolecular modeling suite — protein-structure-refinement / classical-protein-design
Research / method authors
Open Source Model · Open Source
7-billion parameter long-context genomic transformer predicting and generating whole operons and plasmids
Arc Institute & Stanford University
Open Source Software · Open Source
High-performance molecular dynamics simulation software for biomolecular systems
GROMACS Development Team
Open Source Software · Open Source
High-throughput molecular docking and virtual screening software
Scripps Research Institute
Cloud Platform · Commercial Subscription
The leading cloud platform for life sciences R&D informatics, inventory, and molecular design
Benchling
Python Library · Open Source
The essential, foundational Python toolkit for biological computation
Open Bioinformatics Foundation (OBF)
AI Model · Open Source
Large-scale chemical language foundation model for molecular property prediction
IBM Research
Software Toolkit · Open Source
High-performance GPU toolkit for molecular dynamics simulation and machine learning integration
Stanford University (Pande Lab)
Software Tool · Commercial & Open Source Build
The premier open-source foundation and commercial molecular visualization software
Schrödinger
Scientific Software · Open Source
Empirical Bayesian approach for cryo-EM single-particle structure determination
MRC Laboratory of Molecular Biology (Scheres Lab)
Commercial Software · Commercial License
The gold-standard computational platform combining physics-based modeling and machine learning
Schrödinger
AI Model / Web Server · Open Source & Web Service
All-atom biomolecular structure prediction for proteins, nucleic acids, and small molecules
Baidu PaddleHelix
Research software / framework · Public code / project terms
Learned comparison of protein binding-site structures
BenevolentAI / DeeplyTough authors
Research software / framework · Public code / project terms
Unified molecular featurization for ML workflows
Datamol community
Research software / framework · Public code / project terms
Benchmarking platform for molecular generation models
MOSES authors and contributors
Hardware / instrument · Supplier quotation
Automated cell culture with machine-learning-assisted decisions
Molecular Devices
Research software / model · Public code / project terms
Biomolecular complex structure prediction
Chai Discovery
Commercial research software · Provider account / licence
Commercial AI-assisted small-molecule design
Insilico Medicine
Commercial research software · Provider account / licence
AI-assisted generation and prioritization of small molecules
deepmirror
Research software / model · Public code / project terms
Diffusion-based protein-ligand docking
DiffDock authors and contributors
Research software / model · Public code / project terms
Geometric deep-learning prediction of ligand binding poses
EquiBind authors
Research software / model · Public code / project terms
Molecular docking with convolutional neural-network scoring
GNINA contributors
Hardware / instrument · Supplier quotation
High-content imaging integrated with AI-assisted image analysis
Molecular Devices
Commercial research software · Provider account / licence
AI-assisted analysis of high-content biological images
Molecular Devices
Supporting software · Public code / project terms
Python tooling for cheminformatics and molecular modeling
ODDT contributors
Research software / model · Public code / project terms
Biomolecular structure prediction with a public research implementation
ByteDance / Protenix contributors
Research software / model · Public code / project terms
Generative molecular design and optimization
AstraZeneca / MolecularAI contributors
Research software / model · Public code / project terms
Structure modeling of proteins with molecular partners
Baker laboratory
Research software / model · Public code / project terms
Machine-learning toolbox for molecular graphs and drug research
DeepGraphLearning / TorchDrug contributors
Research software / model · Public code / project terms
Learning molecular representations from three-dimensional conformations
DeepModeling / Uni-Mol contributors
Research software / model · Public code
Message-passing molecular property prediction
Chemprop contributors
Research software / model · Public code and weights
Biomolecular structure and affinity prediction
Boltz contributors
Software / platform · Provider-specific terms
Predict biomolecular structures
Google DeepMind
