Nischala G.S.
All projects

Generative chemistry

MolGen

Interactive deep-learning system for molecular generation and property optimisation.

Documented system flow

How MolGen is structured

Select a node to inspect its role.

Chemical representations

Molecular data enters the experimentation workflow.

Interactive readme

Explore MolGen

A concise, source-backed implementation record with the available project actions.

What is documented

  • Generates, analyses, and optimises molecular structures for drug discovery and chemical research.
  • Uses neural generative modelling on chemical representations to explore chemical space while maintaining chemical validity and structural diversity.
  • Integrates preprocessing, training, and property evaluation for drug-likeness and solubility.

Technology used

Deep LearningComputational ChemistryJupyter

Source: supplied LinkedIn. This is a concise visualization of documented components, not a full internal deployment blueprint.