Best AI tools for< Analyze Molecular Structures >

Chemprop is a PyTorch-based framework for training and evaluating message-passing neural networks (MPNNs) for molecular property prediction. Originally developed for research purposes, Chemprop offers a comprehensive set of tools and features for training models and analyzing molecular representations. The package underwent a recent major release (v2.0.0) with significant improvements and updates.

Tempus is an AI-enabled precision medicine company that brings the power of data and artificial intelligence to healthcare. With the power of AI, Tempus accelerates the discovery of novel targets, predicts the effectiveness of treatments, identifies potentially life-saving clinical trials, and diagnoses multiple diseases earlier. Tempus's innovative technology includes ONE, an AI-enabled clinical assistant; NEXT, a tool to identify and close gaps in care; LENS, a platform to find, access, and analyze multimodal real-world data; and ALGOS, algorithmic models connected to Tempus's assays to provide additional insight.

Tempus is an AI-enabled precision medicine company that brings the power of data and artificial intelligence to healthcare. With the power of AI, Tempus accelerates the discovery of novel targets, predicts the effectiveness of treatments, identifies potentially life-saving clinical trials, and diagnoses multiple diseases earlier. Tempus' innovative technology includes ONE, an AI-enabled clinical assistant; NEXT, which identifies and closes gaps in care; LENS, which finds, accesses, and analyzes multimodal real-world data; and ALGOS, algorithmic models connected to Tempus' assays to provide additional insight.

Elicit is a research tool that uses artificial intelligence to help researchers analyze research papers more efficiently. It can summarize papers, extract data, and synthesize findings, saving researchers time and effort. Elicit is used by over 800,000 researchers worldwide and has been featured in publications such as Nature and Science. It is a powerful tool that can help researchers stay up-to-date on the latest research and make new discoveries.

Plerdy is a comprehensive suite of conversion rate optimization tools that helps businesses track, analyze, and convert their website visitors into buyers. With a range of features including website heatmaps, session replay software, pop-up software, website feedback tools, and more, Plerdy provides businesses with the insights they need to improve their website's usability and conversion rates.

TimeComplexity.ai is an AI tool that allows users to analyze the runtime complexity of their code. It works seamlessly across different programming languages without the need for headers, imports, or a main statement. Users can input their code and get insights into its performance. However, it is important to note that the results may not always be accurate, so caution is advised when using the tool.

StockGPT is an AI-powered financial research assistant that provides knowledge of earnings releases, financial reports, and fundamental information for S&P 500 and Nasdaq companies. It offers features like AI-powered search, customizable filters, industry research, and up-to-date data to help users analyze companies and markets more efficiently.

Decode Investing is an AI tool designed to help users discover and analyze businesses for investment purposes. The platform offers features such as an AI Chat assistant, stock screener, SEC filings analysis, earnings calls analysis, and a leaderboard to track performance. Users can access insights and projects to make informed investment decisions. Decode Investing is hand-crafted with a focus on user experience and favorite functionalities.

CLIP Interrogator is a tool that uses the CLIP (Contrastive Language–Image Pre-training) model to analyze images and generate descriptive text or tags. It effectively bridges the gap between visual content and language by interpreting the contents of images through natural language descriptions. The tool is particularly useful for understanding or replicating the style and content of existing images, as it helps in identifying key elements and suggesting prompts for creating similar imagery.

Surveyed.live is an AI-powered video survey platform that allows businesses to collect feedback and insights from customers through customizable survey templates. The platform offers features such as video surveys, AI touch response, comprehensible dashboard, Chrome extension, actionable insights, integration, predefined library, appealing survey creation, customer experience statistics, and more. Surveyed.live helps businesses enhance customer satisfaction, improve decision-making, and drive business growth by leveraging AI technology for video reviews and surveys. The platform caters to various industries including hospitality, healthcare, education, customer service, delivery services, and more, providing a versatile solution for optimizing customer relationships and improving overall business performance.

DINGR is an AI-powered solution designed to help gamers analyze their performance in League of Legends. The tool uses AI algorithms to provide accurate insights into gameplay, comparing performance metrics with friends and offering suggestions for improvement. DINGR is currently in development, with a focus on enhancing the gaming experience through data-driven analysis and personalized feedback.

Comment Explorer is a free tool that allows users to analyze comments on YouTube videos. Users can gain insights into audience engagement, sentiment, and top subjects of discussion. The tool helps content creators understand the impact of their videos and improve interaction with viewers.

This website is an AI tool that helps senior developers analyze AI tech debt. AI tech debt is the technical debt that accumulates when AI systems are developed and deployed. It can be difficult to identify and quantify AI tech debt, but it can have a significant impact on the performance and reliability of AI systems. This tool uses a variety of techniques to analyze AI tech debt, including static analysis, dynamic analysis, and machine learning. It can help senior developers to identify and quantify AI tech debt, and to develop strategies to reduce it.

Architecture Helper is an AI-based application that allows users to analyze real-world buildings, explore architectural influences, and generate new structures with customizable styles. Users can submit images for instant design analysis, mix and match different architectural styles, and create stunning architectural and interior images. The application provides unlimited access for $5 per month, with the flexibility to cancel anytime. Named as a 'Top AI Tool' in Real Estate by CRE Software, Architecture Helper offers a powerful and playful tool for architecture enthusiasts to explore, learn, and create.

ChatInDoc is an AI-powered tool designed to revolutionize the way people interact with and comprehend lengthy documents. By leveraging cutting-edge AI technology, ChatInDoc offers users the ability to efficiently analyze, summarize, and extract key information from various file formats such as PDFs, Office documents, and text files. With features like IR analysis, term lookup, PDF viewing, and AI-powered chat capabilities, ChatInDoc aims to streamline the process of digesting complex information and enhance productivity. The application's user-friendly interface and advanced AI algorithms make it a valuable tool for students, professionals, and anyone dealing with extensive document reading tasks.

LatenceTech is a tech startup that specializes in network latency monitoring and analysis. The platform offers real-time monitoring, prediction, and in-depth analysis of network latency using AI software. It provides cloud-based network analytics, versatile network applications, and data science-driven network acceleration. LatenceTech focuses on customer satisfaction by providing full customer experience service and expert support. The platform helps businesses optimize network performance, minimize latency issues, and achieve faster network speed and better connectivity.

ZeroGPT is a trusted AI detector tool that specializes in detecting AI-generated content like ChatGPT, GPT4, and Gemini. It offers advanced features such as AI summarization, paraphrasing, grammar and spell checking, translation, word counting, and citation generation. The tool is designed to provide highly accurate results and supports multiple languages. ZeroGPT stands out for its highlighted sentences feature, batch file upload capability, high accuracy model, and automatically generated reports. It utilizes DeepAnalyse™ Technology, a multi-stage methodology that optimizes accuracy while minimizing false positives and negatives. Users can unlock premium features and API access to enhance their writing skills and integrate the tool on a large scale.

StrawPoll.ai is an AI-powered platform that offers tools for creating polls, generating charts, and utilizing machine learning to analyze data. Users can easily create polls tailored to their needs, share them to collect responses, and analyze the data using built-in chart and machine learning tools. The platform also provides a chart maker tool for visualizing existing data and a machine learning tool for building predictive models by identifying patterns in the data. Additionally, users can access guides for assistance and contact support for any queries.

Monitr is a data visualization and analytics platform that allows users to query, visualize, and share data in one place. It helps in tracking key metrics, making data-driven decisions, and breaking down data silos to provide a unified view of data from various sources. Users can create charts and dashboards, connect to different data sources like Postgresql and MySQL, and collaborate with teammates on SQL queries. Monitr's AI features are powered by Meta AI's Llama 3 LLM, enabling the development of powerful and flexible analytics tools for maximizing data utilization.

Shortimize is an AI-powered platform designed to help users track, analyze, and explore short-form content across various social media platforms. It offers in-depth tracking of TikTok, Reels, and Shorts accounts by simply adding the URL. With features like AI-Search for viral videos, finding similar accounts and videos, and advanced data analysis, Shortimize aims to enhance short content marketing efforts. The platform provides granular data for every video and account, with 5,000 new viral videos added daily. Shortimize is trusted by leading companies and offers different plans with a 7-day free trial to cater to different user needs.

AI2BMD is a program for efficiently simulating protein molecular dynamics with ab initio accuracy. The repository contains datasets, simulation programs, and public materials related to AI2BMD. It provides a Docker image for easy deployment and a standalone launcher program. Users can run simulations by downloading the launcher script and specifying simulation parameters. The repository also includes ready-to-use protein structures for testing. AI2BMD is designed for x86-64 GNU/Linux systems with recommended hardware specifications. The related research includes model architectures like ViSNet, Geoformer, and fine-grained force metrics for MLFF. Citation information and contact details for the AI2BMD Team are provided.

AI-Drug-Discovery-Design is a repository focused on Artificial Intelligence-assisted Drug Discovery and Design. It explores the use of AI technology to accelerate and optimize the drug development process. The advantages of AI in drug design include speeding up research cycles, improving accuracy through data-driven models, reducing costs by minimizing experimental redundancies, and enabling personalized drug design for specific patients or disease characteristics.

The 'awesome-AI4MolConformation-MD' repository focuses on protein conformations and molecular dynamics using generative artificial intelligence and deep learning. It provides resources, reviews, datasets, packages, and tools related to AI-driven molecular dynamics simulations. The repository covers a wide range of topics such as neural networks potentials, force fields, AI engines/frameworks, trajectory analysis, visualization tools, and various AI-based models for protein conformational sampling. It serves as a comprehensive guide for researchers and practitioners interested in leveraging AI for studying molecular structures and dynamics.

Scientific Large Language Models (Sci-LLMs) is a repository that collects papers on scientific large language models, focusing on biology and chemistry domains. It includes textual, molecular, protein, and genomic languages, as well as multimodal language. The repository covers various large language models for tasks such as molecule property prediction, interaction prediction, protein sequence representation, protein sequence generation/design, DNA-protein interaction prediction, and RNA prediction. It also provides datasets and benchmarks for evaluating these models. The repository aims to facilitate research and development in the field of scientific language modeling.

Docling is a tool that bundles PDF document conversion to JSON and Markdown in an easy, self-contained package. It can convert any PDF document to JSON or Markdown format, understand detailed page layout, reading order, recover table structures, extract metadata such as title, authors, references, and language, and optionally apply OCR for scanned PDFs. The tool is designed to be stable, lightning fast, and suitable for macOS and Linux environments.

Docling simplifies document processing, parsing diverse formats including advanced PDF understanding, and providing seamless integrations with the general AI ecosystem. It offers features such as parsing multiple document formats, advanced PDF understanding, unified DoclingDocument representation format, various export formats, local execution capabilities, plug-and-play integrations with agentic AI tools, extensive OCR support, and a simple CLI. Coming soon features include metadata extraction, visual language models, chart understanding, and complex chemistry understanding. Docling is installed via pip and works on macOS, Linux, and Windows environments. It provides detailed documentation, examples, integrations with popular frameworks, and support through the discussion section. The codebase is under the MIT license and has been developed by IBM.

Towhee is a cutting-edge framework designed to streamline the processing of unstructured data through the use of Large Language Model (LLM) based pipeline orchestration. It can extract insights from diverse data types like text, images, audio, and video files using generative AI and deep learning models. Towhee offers rich operators, prebuilt ETL pipelines, and a high-performance backend for efficient data processing. With a Pythonic API, users can build custom data processing pipelines easily. Towhee is suitable for tasks like sentence embedding, image embedding, video deduplication, question answering with documents, and cross-modal retrieval based on CLIP.

New AI Drug Discovery is a repository focused on the applications of Large Language Models (LLM) in drug discovery. It provides resources, tools, and examples for leveraging LLM technology in the pharmaceutical industry. The repository aims to showcase the potential of using AI-driven approaches to accelerate the drug discovery process, improve target identification, and optimize molecular design. By exploring the intersection of artificial intelligence and drug development, this repository offers insights into the latest advancements in computational biology and cheminformatics.

A public repository collecting links to state-of-the-art training sets, QA, benchmarks and other evaluations for various ML and LLM applications in materials science and chemistry. It includes datasets related to chemistry, materials, multimodal data, and knowledge graphs in the field. The repository aims to provide resources for training and evaluating machine learning models in the materials science and chemistry domains.

Awesome-Graph-LLM is a curated collection of research papers exploring the intersection of graph-based techniques with Large Language Models (LLMs). The repository aims to bridge the gap between LLMs and graph structures prevalent in real-world applications by providing a comprehensive list of papers covering various aspects of graph reasoning, node classification, graph classification/regression, knowledge graphs, multimodal models, applications, and tools. It serves as a valuable resource for researchers and practitioners interested in leveraging LLMs for graph-related tasks.

This repository serves as an educational resource for pharmaceutical and chemistry students to learn the basics of Deep Learning through a collection of Jupyter Notebooks. The content covers various topics such as Introduction to Jupyter, Python, Cheminformatics & RDKit, Linear Regression, Data Science, Linear Algebra, Neural Networks, PyTorch, Convolutional Neural Networks, Transfer Learning, Recurrent Neural Networks, Autoencoders, Graph Neural Networks, and Summary. The notebooks aim to provide theoretical concepts to understand neural networks through code completion, but instructors are encouraged to supplement with their own lectures. The work is licensed under a Creative Commons Attribution-NonCommercial-ShareAlike 4.0 International License.

AIRS is a collection of open-source software tools, datasets, and benchmarks focused on Artificial Intelligence for Science in Quantum, Atomistic, and Continuum Systems. The goal is to develop and maintain an integrated, open, reproducible, and sustainable set of resources to advance the field of AI for Science. The current resources include tools for Quantum Mechanics, Density Functional Theory, Small Molecules, Protein Science, Materials Science, Molecular Interactions, and Partial Differential Equations.

AITom is an open-source platform for AI-driven cellular electron cryo-tomography analysis. It is developed to process large amounts of Cryo-ET data, reconstruct, detect, classify, recover, and spatially model different cellular components using state-of-the-art machine learning approaches. The platform aims to automate cellular structure discovery and provide new insights into molecular biology and medical applications.

This repository contains a comprehensive collection of 63 must-know Large Language Models (LLMs) interview questions. It covers topics such as the architecture of LLMs, transformer models, attention mechanisms, training processes, encoder-decoder frameworks, differences between LLMs and traditional statistical language models, handling context and long-term dependencies, transformers for parallelization, applications of LLMs, sentiment analysis, language translation, conversation AI, chatbots, and more. The readme provides detailed explanations, code examples, and insights into utilizing LLMs for various tasks.

Awesome Generative AI is a curated list of modern Generative Artificial Intelligence projects and services. Generative AI technology creates original content like images, sounds, and texts using machine learning algorithms trained on large data sets. It can produce unique and realistic outputs such as photorealistic images, digital art, music, and writing. The repo covers a wide range of applications in art, entertainment, marketing, academia, and computer science.

AIMNet2 Calculator is a package that integrates the AIMNet2 neural network potential into simulation workflows, providing fast and reliable energy, force, and property calculations for molecules with diverse elements. It excels at modeling various systems, offers flexible interfaces for popular simulation packages, and supports long-range interactions using DSF or Ewald summation Coulomb models. The tool is designed for accurate and versatile molecular simulations, suitable for large molecules and periodic calculations.

I assist with statistical analysis for molecular biology

Research assistant for Atomic, Molecular, and Optics Physics

Academic-level genomics expertise.

Genome Guide: Powered by OpenAI - A leader in genomic data analysis.

Echoes Watson & Crick, educates on DNA with depth.

A GPT that can provides lectures on Statistical Mechanics

I analyze cognitive biases in scenarios and thoughts, providing neutral, educational insights.

Analyze and reverse engineer images. Receive style descriptions and image re-creation prompts.

I'll help you analyze market news and charts for trading/investing

I read and analyze annual reports of companies. Just upload the annual report PDF and start asking me questions!

As a Good Design Advisor, I provide consultation and advice on design topics and analyze designs that are provided through documents or links. I can also generate visual representations myself to illustrate design concepts.

I analyze historical events, offering insights from multiple perspectives.

For strategic knowledge distillation, upload the document you need to analyze and use !start. ENSURE the uploaded file shows DOCUMENT and NOT PDF. This workflow requires leveraging RAG to operate. Only a small amount of PDFs are supported, convert to txt or doc. For timeout, refresh & !continue

Critically analyze SLIs/SLOs with a deeper, provocative approach

Analyze any uploaded art piece, providing thoughtful insight on the history of the piece and its maker. Replicate art pieces in new styles generated by the user. Be an overall expert in art and help users navigate the art scene. Inform them of different types of art

I analyze situations using game theory to advise on the best strategic approach.

I analyze website screenshots for UI/UX improvements.

A tool for historians to analyze and catalog historical images and documents.

Hone your phishing detection skills! Analyze emails, texts, and calls to spot deception. Become a security pro!

I analyze audition sides to help actors prepare for in-person and self-taped auditions for TV and Film