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ESMFold v1

$0.005 / call

Fast single-sequence protein structure prediction.

Input: amino acid sequence → Output: PDB structure + pLDDT confidence score

[BIOLOGY]Meta AI·~200ms

ESM-2 650M

$0.002 / call

Protein language model embeddings for ML pipelines.

Input: amino acid sequence → Output: 1280-dimensional embedding vector

[BIOLOGY]Meta AI·~90ms

ProteinMPNN

$0.005 / call

De novo protein sequence design from backbone structure.

Input: PDB structure → Output: designed sequences + recovery scores

[BIOLOGY]Baker Lab·~300ms

Boltz-2

$0.010 / call

Biomolecular complex structure prediction at AF3 quality.

Input: protein sequences → Output: complex PDB + confidence scores

[BIOLOGY]MIT·~2min

ChemBERTa-2

$0.002 / call

Molecular embeddings and property prediction from SMILES.

Input: SMILES string → Output: embeddings + molecular properties

[CHEMISTRY]Seyone Chithrananda·~80ms

RDKit

$0.001 / call

Molecular properties, fingerprints, and similarity.

Input: SMILES string → Output: properties + Morgan fingerprint + similarity score

[CHEMISTRY]RDKit Community·~20ms

MolT5

$0.003 / call

Natural language descriptions of molecules from SMILES.

Input: SMILES string + task → Output: text description or IUPAC name

[CHEMISTRY]Google Research·~400ms

DiffDock

$0.008 / call

Molecular docking via diffusion model.

Input: protein PDB + ligand SMILES → Output: binding poses + affinity scores

[CHEMISTRY]MIT·~5min

MACE-MP-0

$0.005 / call

Universal ML force field — energy and forces for any material.

Input: atomic structure → Output: energy (eV) + forces (eV/Å)

[PHYSICS]Cambridge / DeepMind·~150ms

NequIP

$0.005 / call

Equivariant neural network interatomic potential.

Input: atomic structure + cutoff → Output: energy (eV) + forces (eV/Å)

[PHYSICS]MIT / Harvard·~200ms

DeePMD

$0.005 / call

Deep potential molecular dynamics force field.

Input: atomic structure + box → Output: energy + forces + virial tensor

[PHYSICS]Deep Modeling·~200ms
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Boltz-2 · DiffDock · RFdiffusion · Nucleotide Transformer · scGPT

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