Moleculogic

SEI-Governed Deterministic Logic Engine

Deterministic Logic Blueprinting for Therapeutic Design. Engineer programmable molecular therapeutics through traceable, rule-governed architectures.

Logic Blueprints, Not Molecules

Moleculogic does not generate random molecules. It constructs logical blueprints that define what a therapeutic must do, not what it must look like. Each blueprint may produce many valid molecular candidates, but each candidate must obey the logic, risk exclusions, and entropy conditions encoded in its parent blueprint.

Traditional AI Drug Discovery

  • Statistical correlation-based
  • Black-box inference
  • Requires labeled datasets
  • Difficult to audit or explain

Moleculogic Deterministic Logic

  • Mechanistically embedded rules
  • Fully explainable outcomes
  • No machine learning required
  • Submission-ready by design

Blueprint Architecture

Moleculogic blueprints are stored in standardized JSON graph structures or Structured YAML Workflows (SYW), allowing traceable rule inheritance, entropy validation, and compound simulation.

Blueprint Components

  • Logic node chains - Causal logic gates (e.g., "If ROS↑ and pH↓ β†’ activate redox cascade")
  • Rule triggers - Tagged rules (e.g., RULE-MYC-SUPPRESS-005, RULE-NRF2-UPREG-002)
  • Entropy class tag - Stability classification and drift suppression logic
  • Redox/metabolic overlays - Domain-specific biological constraints
  • Failure vector audit trace - Known risk patterns and exclusion logic

Unique Identification

Each blueprint is uniquely hashed and cryptographically signed, enabling:

Regulatory alignment and audit trails
Version control and evolution tracking
Zero-knowledge proof capabilities

SEI-Compliant Rule Library

All Moleculogic logic is governed by a curated SEI-compliant rule_library.json which encodes biochemical, pharmacodynamic, and toxicologic logic primitives.

Deterministic Inheritance

Each blueprint inherits rules deterministically and can be rescored under updated biological knowledge or regulatory flags.

Regulatory Compliance

Built-in FDA, EMA, and PMDA compliance markers including pediatric risk triggers and mutagenicity flags.

Cross-Blueprint Consistency

Ensures consistent logic application across therapeutic classes with traceable rule fingerprints.

Deterministic Pipeline

The Moleculogic pipeline proceeds deterministically through each stage with full traceability and audit capability.

1

Blueprint Input

Define logic gates, triggers, and constraints

2

Rule Inheritance

Apply SEI-compliant rule library

3

Entropy Validation

Stability audits and risk scanning

4

Traceable Export

Candidate generation with full provenance

Anti-Failure Architecture

Moleculogic's failure-as-input architecture encodes known biological and clinical failure vectors directly into its exclusion logic, preventing generation of molecules that inherit known risk.

Failure Vectors Prevented

  • Off-target toxicity patterns
  • Immunogenicity triggers
  • Poor solubility profiles
  • Redox collapse mechanisms
  • Non-translatable mechanistic models

Resulting Benefits

  • Reduced clinical trial attrition
  • Prevented late-stage safety failures
  • Enhanced mechanistic validity
  • Improved clinical justification
  • Faster regulatory approval paths

Two Tracks, One Engine

Moleculogic powers both Metal Drug Complex (MDC) and Functional Drug Complex (FDC) frameworks with the same logic-based approach, each optimized for distinct therapeutic mechanisms.

MDC: Metal Drug Complexes

Metal-coordinated compounds guided by energy surfaces, charge-based interaction maps, and multi-ligand binding logic. Incorporates metal valence states, coordination orbitals, and charge-density overlays.

Transition metal coordination chemistry
Redox-active ligand frameworks
Charge-based selectivity mechanisms
Learn more about MDC

FDC: Functional Drug Complexes

Peptide, protein, RNA, and synthetic organic logic systems modeled for programmable therapeutics. Includes dynamic folding logic for peptides, RNA base-pairing thermodynamics, and functional motif triggers.

Protein folding and stability logic
RNA secondary structure prediction
Synthetic organic modular assembly
Learn more about FDC

Reflexive Audit and Governance

Each blueprint is evolution-aware and version-traceable, supporting zero-knowledge proof stubs for regulatory audits and reflexive audit loops for logic self-correction.

Zero-Knowledge Proofs

Enable regulatory audits without exposing IP through cryptographic proof stubs and selective disclosure mechanisms.

Traceable Logic Graphs

Full provenance trails for submission or partner review with human and machine-readable audit capabilities.

Reflexive Audit Loops

Blueprint self-correction capabilities that enable recontextualization under new clinical insights without provenance erasure.

Tiered System Access

Moleculogic offers progressive access tiers from public previews to full co-development sandboxes with blueprint export capabilities.

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Tier 0

Public overview of molecule logic structure types and static blueprint displays (no simulation access).

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Tier 1

NDA-gated logic viewer and blueprint previewer with basic entropy overlays and rule library access.

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Tier 2

Secure compound designer with programmable states, input parameters, verification gates, and blueprint export.

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Tier 3+

Full traceable sandbox with co-development, logic exports, lifecycle monitoring, and zero-knowledge audit tools.

MDC Tier 0 Preview

Explore the metal-ligand coordination logic that drives MDC simulations. Public access to predefined molecular blueprints with entropy outputs and coordination chemistry demonstrations.

Launch MDC Tier 0 Preview

FDC Tier 0 Preview

Discover peptide, RNA, and protein-driven compound frameworks. Includes static FDC blueprints with folding logic demonstrations and functional motif previews built for public review.

Launch FDC Tier 0 Preview

Logic Is the New Molecule

Moleculogic is not drug discovery. It is drug logic engineering. A blueprint-first approach to deterministic, traceable, and clinically compliant therapeutics. We don't generate drug candidates; we generate logical constructs that can become drugs. Every blueprint has a trail. Every trail has validation gates.

"Moleculogic is the AlphaFold moment for conditional drug logic, putting deterministic simulation at the core of programmable molecular therapy."