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ACEMD
Software framework for molecular dynamics-based discovery and the first biomolecular simulation code to run on GPUs.
What is ACEMD?
Software framework for molecular dynamics-based discovery and the first biomolecular simulation code to run on GPUs. Includes ACEMD and OpenMM engines, HTMD, TorchMD, and TorchMD-Net.
Product typeDrug Discovery & Biotech
Pricing · Free, Subscription
Deployment
APINot available
What teams use ACEMD for
AI-driven drug discovery
Binding free energy calculations
ADME predictive modeling
Virtual screening
Integrations and access
Platforms, integrations, and language support vary by plan and region. Confirm final requirements with the vendor.
Platforms
IntegrationsAPI and webhooks
Languages
Support
What reviewers say
Community reviewsReviews are owned and editable by their authors.
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Enterprise readiness
Compliance claims are normalized from current vendor documentation and independently reviewed by SOTA2.
ISO/IEC 27001
Information Security Management System (ISMS) aligned with ISO 27001
Confidentiality controls preventing unauthorized disclosure and access
Integrity controls ensuring accuracy and preventing deterioration of customer information
Availability controls ensuring access to customer information across all media
Annual information security objectives
Risk analysis, management, and treatment process for information assets
Control objectives and controls to mitigate identified risks
Security breach reporting by employees
Information security training and awareness for all personnel
Strict security procedures for storage and disclosure of personal data
Third-party security requirements aligned with Spanish and EU data protection rules
Data retention:
Benchmarks and comparisons
Independent benchmarksStructured task results are being verified.
Side-by-side comparisonsComparison workspaces will be available in a later release.
