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Drug Discovery & Molecular Design
Showing 165 results
DeepMirror logo
DeepMirror

by DeepMirror

AI-guided molecule design for hit-to-candidate optimization, combining generative models, potency prediction, and structure-based design.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
Cradle logo
Cradle

by Cradle

AI-driven protein design and optimization that accelerates R&D timelines 2–12x by solving multi-property trade-offs and learning from your experimental data.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
peleke-1 logo
peleke-1

by Silico Biosciences

Targeted antibody sequence generation from antigen inputs using fine-tuned protein language models.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
AQBioSim logo
AQBioSim

by Sandbox AQ

AI-driven molecular simulation and binding affinity prediction for accelerated small molecule and biologic drug discovery.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
AQChemSim logo
AQChemSim

by Sandbox AQ

Large quantitative models for accelerated discovery and optimization of batteries, catalysts, and advanced materials.

Drug Discovery & Molecular Design
Molecular Modeling & Simulation
MP4 logo
MP4

by 310.ai

Generate high-quality de novo proteins from text prompts, with 6,500+ AI-designed enzymes and 84% lab expression rates.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
Superbio.ai Platform logo
Superbio.ai Platform

by superbio.ai

Community-driven AI models for protein folding, binding prediction, and molecular analysis in biology research.

Drug Discovery & Molecular Design
Molecular Docking & Virtual Screening
Apps Marketplace logo
Apps Marketplace

by superbio.ai

Community-driven AI model marketplace for biology research, from protein design to omics analysis.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
Copilot AI Research Assistant logo
Copilot AI Research Assistant

by superbio.ai

AI model marketplace for biology research with GPU-accelerated computing, fine-tuning, and batch job capabilities.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
Chemistry42 logo
Chemistry42

by Insilico Medicine

De novo molecular design and optimization using generative AI and physics-based methods for small-molecule drug discovery.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
Biology42: Generative Biologics logo
Biology42: Generative Biologics

by Insilico Medicine

De novo design and optimization of peptides, nanobodies, and antibodies for hard-to-drug targets using generative AI and predictive modeling.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
ESM3 logo
ESM3

by EvolutionaryScale

Generative AI for protein design that reasons over sequence, structure, and function simultaneously.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
OpenProtein.AI Platform logo
OpenProtein.AI Platform

by OpenProtein.AI

Machine learning-guided protein engineering to design optimized variants and predict function from sequence data.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
ApherisFold logo
ApherisFold

by Apheris

Run, benchmark, and fine-tune co-folding models locally on proprietary drug discovery data with interactive 3D inspection and API integration.

Drug Discovery & Molecular Design
Molecular Modeling & Simulation
Tesela AI logo
Tesela AI

by Teselagen

AI agents for DNA library design, assembly protocol generation, biomolecule optimization, and experimental analysis in biological R&D.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
Pending AI Platform logo
Pending AI Platform

by Pending AI

Quantum mechanics and AI-guided drug discovery for identifying novel candidates across traditionally undruggable targets.

Drug Discovery & Molecular Design
Quantum & Physics-Enhanced Drug Design
Enki logo
Enki

by Variational

Generative AI for novel, synthesizable small molecules optimized to your target product profile.

Drug Discovery & Molecular Design
Generative Molecular & Biologics Design
ChemX logo
ChemX

by Raven Biosciences

AI-driven QSAR/QSPR modeling with explainable predictions for drug discovery. Train custom models or use pre-built ADMET predictors with automated featurization and molecular screening.

Drug Discovery & Molecular Design
Cheminformatics & Compound Management
EpiC logo
EpiC

by Raven Biosciences

Atomistic epitope characterization and antibody-antigen interface prediction using molecular docking and dynamics simulations.

Drug Discovery & Molecular Design
Molecular Modeling & Simulation
Orion Molecular Design Platform logo
Orion Molecular Design Platform

by OpenEye

Molecular design and simulation on cloud for virtual screening, lead optimization, and quantum chemistry calculations.

Drug Discovery & Molecular Design
Molecular Docking & Virtual Screening