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free energy calculations

Suppliers
2
States & provinces
2
Countries
2

2 free energy calculations suppliers across 2 states and provinces in 2 countries. Profiles show capabilities, materials, certifications, and facility locations so you can compare shops and build a shortlist.

Suppliers

ACELLERA LABS SL.

BARCELONA, BARCELONA

Acellera is a physics, machine learning and software company founded in 2006 that builds software to make drug discovery computable. It ships three products: PlayMolecule AI, an AI co-scientist for drug discovery; QuantumBind Lab, a molecular physics execution layer for agents; and ACEMD Toolkit, a Python ecosystem for molecular simulation. The company runs its own internal discovery programs and publishes results, and is ISO 27001 certified.

drug discovery softwareenhanced samplingGPU molecular dynamicsMachine Learningmolecular dynamics simulationstructural analysissystem preparationTrajectory analysis

Compiled from public sources

ENTROPY MAXIMA LLC

SAN FRANCISCO, CA

Entropy Maxima LLC was founded by Noel Carrascal in 2018 and is based in San Francisco. The company aims to accelerate the pace of discovery of new protein-based therapeutics and materials by developing new interpretations of established thermodynamic principles, viewing computational chemistry problems from the entropy maxima perspective.

antibody modellingcomputational chemistryMachine LearningMMGBSAmolecular dynamics simulationsprotein-protein dockingsolvent models

Compiled from public sources

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