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MCP servers tagged drug-discovery
36 live MCP servers tagged "drug-discovery", ranked by trust score. Tags come from package metadata and repository topics, so this list covers servers across every category that work with drug-discovery.
Opentargets MCP
MCP server for Open Targets data
Rdkit MCP Server
MCP server that enables language models to interact with RDKit through natural language
Alphafold MCP Server
A comprehensive Model Context Protocol (MCP) server that provides access to the AlphaFold Protein Structure Database through a rich set of tools and resources for protein structur…
Pdb MCP Server
A Model Context Protocol (MCP) server that provides access to the Protein Data Bank (PDB) - the worldwide repository of information about the 3D structures of proteins, nucleic ac…
Augmented Nature Uniprot MCP Server
A comprehensive Model Context Protocol (MCP) server providing advanced access to the UniProt protein database.
Biomed Agent
Connecting AI to biomedical data
Refua MCP
MCP server exposing strict typed Refua tools for Boltz2 folding, affinity prediction, and BoltzGen design workflows.
ScienceClaw
ScienceClaw is a personal research assistant built with LangChain DeepAgents and AIO Sandbox infrastructure, adopting a completely new architecture beyond OpenClaw. It offers stro…
K Dense Byok
An AI co-scientist powered by Scientific Agent Skills running on your desktop.
ChemMCP
Chemistry tools for AI agents via the Model Context Protocol — validate, describe, draw, and look up compounds from PubChem and ChEMBL.
Blatant Why
AI-powered biologics design campaign agent — multi-agent orchestration with BoltzGen, PXDesign, Protenix, and 200+ cloud tools. Antibodies, nanobodies, de novo binders, and beyond.
Awesome Bio Agent Skills
A curated collection of AI agent skills for biomedical research, covering genomics, proteomics, single-cell analysis, clinical AI, and protein design.
Augmented Nature Uniprot Server
A comprehensive Model Context Protocol server for accessing UniProt protein database with 26 bioinformatics tools for protein research, comparative genomics, and systems biology
Chematic
A pure-Rust cheminformatics library targeting RDKit feature parity — zero C/C++ by default.
MedClaw
Open-source biomedical research agent with 60+ offline tools: variant interpretation. Use via web chat UI or MCP (DeepSeek-harness compatible).
Openclaw Medical Harness
🏥 Medical AI Agent Orchestration Framework. 5-step harness pipeline + MCP tools + multi-agent coordination.
Awesome Scientific AI Tools
Discover AI tools, MCP servers, and agent skills for scientific research across literature, data, writing, and lab work
Bioresearcher Skills
Agent Skills/Plugins/Connectors for biomedical research with the biomcp-ts MCP server.
Heuris BioMCP
BioMCP - Comprehensive MCP server for bioinformatics and life sciences
Lifesciences Research
AI Agent wrappers for Life Sciences APIs (Open Targets, ChEMBL, UniProt). Accelerating drug discovery with Model Context Protocol (MCP) and FastMCP.
Oncotarget Luad
Scientific MVP for LUAD target prioritization using knowledge graphs, GraphSAGE, and GraphRAG.
Novomcp
The open computational chemistry engine for drug discovery and materials science; MCP + REST + Workbench + Next.js dashboard, wrapping RDKit, GROMACS, AutoDock, OpenFold, Chai, Bo…
Oncora
Oncora — A Reproducible, Uncertainty-Aware Agentic Reasoning Platform for Oncology Drug Discovery (Rust-native, on-prem, MCP)
Chilecule
Agentic drug discovery workflows on fully open-source tooling: RDKit, AutoDock Vina/smina, fpocket, ChEMBL. MCP tool servers + Claude agents, with a retrospective validation harne…
Litmuz Agent
Claim-level verification for life-sciences research agents: honest, auditable, per-claim traffic-light verdicts against the primary literature and genomic reference data. MCP-nati…
Mychem MCP
MCP server for MyChem.info API
OpentargetMCP
Powerful Model Context Protocol (MCP) server for therapeutic discovery and drug repurposing using the Open Targets Platform GraphQL API.
Scikit
A unified life science data layer for your AI agents - genomics, proteomics, drug discovery, clinical trials across 300+ databases.
Cyclicchamp MCP
CyclicCHAMP MCP server for cyclic peptide modeling
Sandboxaq
SandboxAQ — independent third-party profile of a public API surface, by API Evangelist. SandboxAQ (SB Technology, Inc.) builds Large Quantitative Models (LQMs) — AI systems that f…
Afcycdesign MCP
AF-CycDesign MCP server for cyclic peptide design with AlphaFold
Pharmpapp MCP
PharmPApp MCP server for pharmaceutical peptide property prediction
DX LAB
AI-powered drug discovery platform integrating intelligent knowledge search, molecule design, 3D visualization, patient-specific safety evaluation, hypothesis generation, and auto…
Cpmp MCP
CPMP MCP server for cyclic peptide membrane permeability prediction
Cyclicpeptide MCP
Cyclic peptide MCP server for cyclic peptide design and analysis
Sample Agentcore Scverse
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