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    Promethium

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    Sold by: QC Ware 
    Get to the winning molecule faster! Discover drugs, chemicals, catalysts, and materials faster and at lower cost. This modern ab initio SaaS platform allows high accuracy molecular simulations at unprecedented speeds. Unrivaled performance, accuracy, and capabilities make this platform an indispensable part of the discovery process.

    Overview

    FREE TRIAL for new sign-ups, as outlined here: https://promethium.qcware.com/pricing 

    Welcome to a modern ab initio platform for the discovery of new drugs, chemicals, catalysts, and materials.

    The accuracy and speed of this electronic structure platform increases predictiveness, and reduces the number of compounds that need experimental testing. Deep insights into the underlying mechanisms of reactions and interactions allow customers to optimize leads more efficiently.

    Key ab initio capabilities for up to 2,000 atom systems:

    • Molecular properties (incl. single point energy, geometry optimization, conformer search, torsion scans)
    • Interaction energies
    • Reaction paths (incl. transition state and reaction path optimization)

    The platform includes a variety of options, including implicit solvation, support for high angular momentum functions, excited states via time-dependent density functional theory, effective core potentials for metal atoms, and support for all elements through to Radon.

    Your use of Promethium will be subject to QC Ware's then-applicable compute runtime pricing which will always be available on our pricing website: https://promethium.qcware.com/pricing 

    New accounts may be eligible for free trial usage before standard rates apply.

    Highlights

    • Get to your winning molecule faster!
    • Save time & experimental costs
    • High accuracy ab initio molecular simulations at unprecedented speeds

    Details

    Delivery method

    Deployed on AWS

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    Features and programs

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    Pricing

    Pricing is based on the duration and terms of your contract with the vendor, and additional usage. You pay upfront or in installments according to your contract terms with the vendor. This entitles you to a specified quantity of use for the contract duration. Usage-based pricing is in effect for overages or additional usage not covered in the contract. These charges are applied on top of the contract price. If you choose not to renew or replace your contract before the contract end date, access to your entitlements will expire.
    Additional AWS infrastructure costs may apply. Use the AWS Pricing Calculator  to estimate your infrastructure costs.

    12-month contract (1)

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    Dimension
    Description
    Cost/12 months
    Account
    Promethium Account
    $0.00

    Additional usage costs (1)

     Info

    The following dimensions are not included in the contract terms, which will be charged based on your usage.

    Dimension
    Cost/unit
    https://promethium.qcware.com/pricing
    $0.01

    Vendor refund policy

    No refunds

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    Legal

    Vendor terms and conditions

    Upon subscribing to this product, you must acknowledge and agree to the terms and conditions outlined in the vendor's End User License Agreement (EULA) .

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    Usage information

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    Delivery details

    Software as a Service (SaaS)

    SaaS delivers cloud-based software applications directly to customers over the internet. You can access these applications through a subscription model. You will pay recurring monthly usage fees through your AWS bill, while AWS handles deployment and infrastructure management, ensuring scalability, reliability, and seamless integration with other AWS services.

    Support

    Vendor support

    Support is available to customers, please email promethium@qcware.com 

    AWS infrastructure support

    AWS Support is a one-on-one, fast-response support channel that is staffed 24x7x365 with experienced and technical support engineers. The service helps customers of all sizes and technical abilities to successfully utilize the products and features provided by Amazon Web Services.

    Product comparison

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    Updated weekly
    By QC Ware
    By TandemAI
    By D-Wave Commercial Inc.

    Accolades

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    Top
    10
    In Education & Research, High Performance Computing, Healthcare & Life Sciences
    Top
    10
    In Healthcare & Life Sciences, Application Stacks
    Top
    100
    In Analytic Platforms

    Overview

     Info
    AI generated from product descriptions
    Molecular Simulation Capabilities
    Advanced ab initio platform supporting molecular properties, interaction energies, and reaction path calculations for systems up to 2,000 atoms
    Quantum Chemistry Modeling
    Supports comprehensive electronic structure calculations including geometry optimization, conformer search, and torsion scans
    Computational Chemistry Techniques
    Includes advanced modeling options like implicit solvation, high angular momentum functions, and time-dependent density functional theory
    Element Coverage
    Comprehensive elemental support from lightest elements through to Radon, with effective core potentials for metal atoms
    Excited State Simulation
    Capability to perform excited state calculations using time-dependent density functional theory for complex molecular systems
    Web-Based Platform
    Provides a web-based interface accessible through a browser for computational analysis and data visualization
    AI Computational Tools
    Integrates cutting-edge AI and physics-based computational tools for scientific research and analysis
    Free-Energy Perturbation Workflow
    Implements advanced Free-energy perturbation (FEP) workflow for predicting protein-small molecule binding affinities
    Generative AI Approaches
    Supports multiple reaction-based and generative AI powered approaches for small molecule ideation
    Resource Provisioning
    Automates computational resource provisioning and configuration in cloud infrastructure
    Quantum Computing Architecture
    4400+ qubit Advantage2 quantum computers using superconducting qubit technology
    Hybrid Solver Capability
    Quantum-classical hybrid solvers capable of processing problems with up to 2 million variables and 100,000 constraints
    Developer Environment
    Web-based integrated development environments with Python tools, open-source Ocean SDK, and practical coding examples
    Computational Scale
    Quantum systems supporting large-scale computational problems across optimization and artificial intelligence domains
    Quantum Technology Type
    Supports both annealing and gate-model quantum computing approaches

    Contract

     Info
    Standard contract
    No
    No
    No

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