Molecular Docking
The best 50 Molecular Docking AI tools - Free & Paid
Explore 50 AI for Molecular Docking
Termdock is a terminal-centric AI development environment that consolidates multi-workspace, multi-terminal workflows with resizable windows and picture-in-picture monitoring, AST-driven code analysis across 13+ languages, drag-and-drop CLI inputs, unified caching, search, and Git visualizations.
Freemium
Calldock is an AI-driven voice agent platform that facilitates lead generation and appointment booking. It automates customer interactions, integrates with scheduling tools, and enhances communication through SMS and email, streamlining follow-ups and improving conversion rates.
Free trial
Docky.ai is an AI-driven sidebar tool for web browsers that offers access to multiple AI models for answering questions, summarizing documents, and improving search results, enhancing productivity for professionals, students, and researchers with seamless usability.
Subscription
Enki™ is a generative AI platform for early‑stage drug discovery that designs synthesizable small molecules meeting user‑defined targets and over 50 properties, delivering synthesis‑ready candidates within weeks. It supports oncology and therapeutic areas, and integrates with research and partners f
Free
GitHub Copilot is an AI pair programmer that uses the OpenAI Codex to suggest code and entire functions in real-time.
Free trial
Tensordock provides cloud GPU services for AI workloads, featuring on-demand Nvidia H100, A100, and RTX 4090 GPUs. It supports rapid deployment, extensive documentation, and efficient management of virtual environments for diverse applications.
Freemium
DrugCard automates literature screening and pharmacovigilance for CROs and regulators, using OCR to detect drug mentions in 100+ languages across 2,200+ journals. It delivers real‑time alerts and audit‑ready reports, saving 50–70 % of manual time.
Free
Semantic Scholar indexes 230 million papers, offering AI‑powered semantic search that prioritizes relevance and citation impact. It provides contextual PDF annotations, a developer API, and export options for literature reviews, grant research, and teaching.
Free
Open-claw.org is a premium, subscription-based AI deployment platform that lets you launch powerful AI agents in one click
Freemium
DeepMotion converts video or text into realistic 3‑D character animation, extracting motion from a single camera and offering real‑time body and facial tracking for game devs, VR artists, and content creators. Its API integrates into pipelines, speeding production.
Freemium
- $9/mo
Synthace is a software and consulting platform that automates multivariate experimental design for assay development, media optimization, and miniaturized purification. It integrates with lab dispensers and LIMS, standardizes workflows, and accelerates data‑driven insights for drug discovery, HTS, a
Freemium
Dovetail's Customer Insights Hub helps product managers and researchers analyze customer feedback through real-time integration with apps like Slack. It offers a searchable repository and AI-driven analysis for qualitative data, enhancing collaboration and informed product decisions.
Freemium
Minicule is an AI tool for medical research, aggregating verified scientific records. It offers advanced search for FDA-approved treatments and clinical trials, supports autonomous agents for discovery, and ensures data privacy with self-hosting options.
Free trial
PaioClaw is an AI platform for building and deploying persistent, autonomous agents ("claws") in under 60 seconds, featuring a marketplace of 2,000+ skills and integrations with 100+ models. It provides persistent memory, workflow automation, and full operational dashboards for monitoring token usag
Freemium
- $15/mo
Pure Global delivers AI‑powered regulatory support for medical devices in 30+ markets, automating dossier compilation, translation, and distributor authorization. Real‑time liaison with local authorities and data tools streamline market registration, pathway strategy, and post‑market compliance.
Paid
Morphllmis a high-throughput AI code-editing platform that applies LLM-generated multi-file edits, automated diffs, and merges at 10,500+ tokens/sec via edit_file and MCP/OpenAI-compatible SDKs (TypeScript, Python) for editor, CI, and agent integration.
It combines warp-grep/warpsearch semantic co
Free trial
Atomic Bot is an AI assistant that centralizes productivity workflows like email, calendar, and document management. It automates web tasks, parses files, and offers multi-model support with local or cloud deployment for privacy-conscious teams.
Freemium
Subatomic deploys AI Co‑Workers that integrate with existing tools—chat, email, Teams, Slack—to clean data, automate routine tasks, generate real‑time reports, and surface insights, cutting turnaround from weeks to minutes without developer involvement or added staff.
Freemium
- $33/mo
TrialPioneer is an AI‑enabled workspace that integrates literature search, data analysis, and scenario modeling for clinical trial design. It automates PubMed, ClinicalTrials.gov, and FDA data collection, harmonizes datasets, and simulates design scenarios to reduce iteration cycles and sample sizes
Freemium
Figr AI is an AI‑driven design platform that generates high‑fidelity mobile and web screens, landing pages, and prototypes in one environment. It uses a memory engine for product intelligence, supports PRD drafting, benchmark research, and design system token management.
Freemium
Provides API access to pretrained image generation models for text‑to‑image, image‑to‑image, and inpainting, with real‑time editing. Supports single‑call Dreambooth/LoRA training without local GPU, plus voice cloning, text‑to‑3D, interior design, and video creation.
Paid
- $27/mo
Jamdesk generates AI-ready documentation sites from MDX with GitHub-integrated CI/CD and CDN deployments, offering semantic search and natural-language chat, MDX components and themes, llms.txt support, versioned Git workflows, analytics, and AI assistant integration.
Free trial
- $29/mo
Mimetic Labs is a 3D model preparation platform that transforms sketches, images, and CAD files into printable models. It automates repair, analysis, and optimization to streamline workflows from design to slicing.
Freemium
Agentic Document Extraction pulls structured data from PDFs, images, spreadsheets using vision‑first parsing, preserving layout and delivering bounding‑box citations. Modular REST APIs and Python/TypeScript SDKs support on‑prem or cloud deployment for regulated sectors needing traceable, accurate ex
Subscription
- $250/mo
Packify converts product descriptions into instant 3‑D packaging mockups and printable dielines. It supplies AI templates for labels, nutrition facts, and regulatory graphics, enables logo and background edits, and integrates with e‑commerce and manufacturers to streamline design and production.
Freemium
Formy 3D converts natural-language prompts and 2D images into textured, production-ready 3D assets with optimized topology and PBR textures. Exports FBX/GLB/OBJ/STL, supports preview/editing, and integrates into Blender, Unity and Unreal.
Free trial
DeepSeek Free provides browser access to 671-billion‑parameter DeepSeek-R1/V3 models for conversational Q&A, code assistance, math solving, and document/image-aware NLP; supports direct use without login, workflow integration, customization, and encrypted data handling.
Free
Synthical is an AI tool in computational chemistry/materials science. It facilitates trend analysis, organic reaction exploration, molecular design using genetic algorithms, and encourages investigation into sustainable technologies across diverse chemical disciplines for enhanced scientific discov
Freemium
Bondapp.io is an AI-powered task manager that automates routine work and streamlines team workflows through centralized task organization, deadline tracking, and collaboration features. It integrates with tools like PostHog and Sentry for usage insights and performance tracking, while offering secur
Subscription
Petal is an AI document analysis platform that links to your knowledge bases to deliver context‑aware, fully sourced answers. It centralizes files in a cloud drive, auto‑extracts metadata, removes duplicates, and supports annotation and collaboration without email.
Freemium
- $2.55/mo
Drawerrr connects engineers, designers, marketers, sustainability experts, students, and professionals to tackle real‑world challenges aligned with UN SDGs and US AID goals. Users choose a category, form teams (≤5) or solo, and submit ideas for jury review, mentorship, and networking.
Free
Docugami transforms unstructured business documents into structured knowledge graphs, extracting key data from contracts, invoices, clinical trials, and more. Its no‑code interface and secure connectors integrate with SharePoint, Google Drive, and ERPs, automating review, compliance, and decision wo
Freemium
Metail EcoShot converts 3D apparel CAD models into realistic on‑model images within ten minutes using computer vision and GANs. It produces marketing‑ready photos, size‑streamed mockups, and fit visualizations without physical prototypes.
Freemium
VibeClaw.dev is a browser-based OpenClaw runtime for running AI coding agents in sandboxed, in-browser Node.js containers. It features a complete virtual filesystem, multi-agent orchestration, and flexible model support from local WebGPU LLMs to cloud APIs, all exportable for private, reproducible w
Freemium
Solar Explorer simulates the Solar System with accurate orbital and rotational physics, offering 3‑D views, surface textures, time‑evolution modes, and mission replays of Pioneer, Voyager, and New Horizons for educational and research use.
Freemium
gNucleus is an AI platform that labels CAD and simulation data, trains custom models, and deploys them across public or private clouds. It automates specification, CAD creation from text or DXF, runs multi‑physics simulations, and optimizes results.
Freemium
- $29.99/mo
HoundDog.ai scans code to detect PII leaks and map data flows across logs, APIs, SDKs, and AI integrations. It auto‑creates GDPR‑aligned documents, blocks risky pull requests in IDEs and CI/CD, and supplies an API context engine for safer AI coding.
Freemium
Molmo AI is an open-source multimodal AI model for text and image processing, offering high-quality outputs on less powerful hardware. It enables easy integration, customization, and collaboration through a user-friendly dashboard for experimentation and analysis.
Free trial
CloudGlue converts video content into structured, LLM-ready data, enabling searchable databases, knowledge graph creation, and chatbot integration. It supports rapid indexing and customizable transcripts, streamlining video analysis for real-time applications across various industries.
Freemium
Alchemi is an enterprise SEO platform that optimizes visibility in zero‑click AI searches by reverse‑engineering LLM retrieval logic, managing technical SEO at scale, and measuring AI citation impact to drive intent and conversion for marketers, SEO specialists, and analysts.
Freemium
- $37
ProdMoh is an AI‑enabled chief‑of‑staff platform that consolidates product intent into a Product Canvas, tracks releases with evidence‑based Decision Queues, auto‑generates launch assets, and aligns engineering, product, and GTM teams while reducing support load.
Paid
Sugarbug is workflow intelligence that connects your fragmented tools – Linear, GitHub, Figma, Slack, Notion, email, calendars – and builds a living knowledge graph of tasks, people, and relationships. Every signal understood, every dropped ball caught. The longer it runs, the smarter it gets.
Freemium
OLINTEK Cargo Load & ULD Build‑up is an AI engine that automatically generates aircraft cargo loading plans and ULD configurations. It visualizes 3‑D loading positions, optimizes space use while complying with aircraft and IATA limits, and offers API integration for adoption.
Subscription
Coval lets teams test, monitor, and manage conversational AI agents by simulating thousands of realistic interactions, tracking metrics such as latency and intent accuracy, sending real‑time alerts, and supporting role‑specific workflows—all under SOC2, HIPAA, and GDPR compliance.
Freemium
Powder automates extraction of data from diverse financial documents—brokerage statements, 401(k), tax returns, etc.—into spreadsheets and asset decks. It populates portfolio reviews, calculates weightings, and produces proposals quickly while ensuring compliance and data security.
Free