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SettingsResearch demo · not for clinical or commercial use
Corollary
  1. Catalog
  2. Chemistry & ADMET
  3. MolMIM

Chemistry & ADMET · NVIDIA BioNeMo

MolMIM

Controlled molecule generation in a well-behaved latent space.

Commercial use permittedThe Apache-2.0 licence allows use in commercial research and products.Apache-2.0
Availability
Ready
Typical latency
8.0s
Credits per run
~56
Compute tier
A · Fast

1–30s

Runs on Managed GPU endpoint

Runs on managed compute. Availability and startup time depend on current capacity.

Run this model

MolMIM

Canonical SMILES for the small molecule.

Needs seed smiles

About this model

MolMIM's mutual-information-machine latent space is smooth enough that property-guided optimisation actually works — you can walk toward a target QED or logP rather than sampling and filtering.

Standardized I/O contract

Every model in the Hub speaks the same contract, which is what lets the Router and the agent call any of them without special-casing.

Inputs

  • smilessmiles · required

    Seed SMILES

  • num_moleculesnumber

    Molecules

  • property_nameselect

    Optimise for

Outputs

  • moleculestable

    Optimised analogues with scores.

Specification

Hardware
1× A100 16GB
GPU memory
16 GB
Version
1.0
Licence
Apache-2.0
Backend
ReadyManaged GPU endpoint
MCP server
mcp-molecule-server

Tasks

molecular generationoptimization
generationlatent-spacenvidia