use crate::anneal_integration::{AnnealingParams, QuantumMLQUBO};
use crate::enhanced_gan::{ConditionalQGAN, WassersteinQGAN};
use crate::error::{MLError, Result};
use crate::keras_api::{
ActivationFunction, Dense, LossFunction, MetricType, OptimizerType, QuantumAnsatzType,
QuantumDense, Sequential,
};
use crate::optimization::{OptimizationMethod, Optimizer};
use crate::pytorch_api::{
ActivationType as PyTorchActivationType, QuantumLinear, QuantumSequential,
};
use crate::qsvm::{FeatureMapType, QSVMParams, QSVM};
use crate::vae::{ClassicalAutoencoder, QVAE};
use quantrs2_circuit::prelude::*;
use quantrs2_core::prelude::*;
use scirs2_core::ndarray::{s, Array1, Array2, ArrayD, IxDyn};
use serde::{Deserialize, Serialize};
use std::collections::HashMap;
pub struct DomainTemplateManager {
templates: HashMap<Domain, Vec<TemplateMetadata>>,
}
#[derive(Debug, Clone, Hash, PartialEq, Eq, Serialize, Deserialize)]
pub enum Domain {
Finance,
Chemistry,
Healthcare,
Logistics,
Energy,
Materials,
Physics,
NLP,
Vision,
Security,
Climate,
Aerospace,
}
#[derive(Debug, Clone, Serialize, Deserialize)]
pub struct TemplateMetadata {
pub name: String,
pub description: String,
pub domain: Domain,
pub problem_type: ProblemType,
pub input_features: Vec<String>,
pub output_description: String,
pub recommended_dataset_size: usize,
pub complexity: ModelComplexity,
pub required_qubits: usize,
pub training_time_estimate: String,
pub performance_notes: String,
}
#[derive(Debug, Clone, Serialize, Deserialize)]
pub enum ProblemType {
BinaryClassification,
MultiClassification,
Regression,
Optimization,
Generation,
AnomalyDetection,
TimeSeriesForecasting,
Clustering,
DimensionalityReduction,
}
#[derive(Debug, Clone, Serialize, Deserialize)]
pub enum ModelComplexity {
Simple,
Intermediate,
Complex,
Research,
}
#[derive(Debug, Clone)]
pub struct TemplateConfig {
pub num_qubits: usize,
pub input_dim: usize,
pub output_dim: usize,
pub parameters: HashMap<String, f64>,
}
impl DomainTemplateManager {
pub fn new() -> Self {
let mut manager = Self {
templates: HashMap::new(),
};
manager.register_templates();
manager
}
fn register_templates(&mut self) {
self.register_finance_templates();
self.register_chemistry_templates();
self.register_healthcare_templates();
self.register_logistics_templates();
self.register_energy_templates();
self.register_materials_templates();
self.register_physics_templates();
self.register_nlp_templates();
self.register_vision_templates();
self.register_security_templates();
self.register_climate_templates();
self.register_aerospace_templates();
}
fn register_finance_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Portfolio Optimization".to_string(),
description: "Quantum portfolio optimization using QAOA for risk-return optimization"
.to_string(),
domain: Domain::Finance,
problem_type: ProblemType::Optimization,
input_features: vec![
"asset_returns".to_string(),
"risk_matrix".to_string(),
"correlation_matrix".to_string(),
],
output_description: "Optimal portfolio weights".to_string(),
recommended_dataset_size: 500,
complexity: ModelComplexity::Intermediate,
required_qubits: 10,
training_time_estimate: "10-30 minutes".to_string(),
performance_notes: "Can outperform classical methods for small portfolios".to_string(),
});
templates.push(TemplateMetadata {
name: "Credit Risk Assessment".to_string(),
description: "Quantum neural network for credit default prediction".to_string(),
domain: Domain::Finance,
problem_type: ProblemType::BinaryClassification,
input_features: vec![
"credit_score".to_string(),
"income".to_string(),
"debt_ratio".to_string(),
"employment_history".to_string(),
"loan_amount".to_string(),
],
output_description: "Default probability".to_string(),
recommended_dataset_size: 10000,
complexity: ModelComplexity::Intermediate,
required_qubits: 8,
training_time_estimate: "1-2 hours".to_string(),
performance_notes: "Competitive accuracy with quantum advantage in training speed"
.to_string(),
});
templates.push(TemplateMetadata {
name: "Fraud Detection".to_string(),
description: "Quantum anomaly detection for financial fraud".to_string(),
domain: Domain::Finance,
problem_type: ProblemType::AnomalyDetection,
input_features: vec![
"transaction_amount".to_string(),
"transaction_time".to_string(),
"merchant_category".to_string(),
"location".to_string(),
"user_behavior_patterns".to_string(),
],
output_description: "Fraud probability".to_string(),
recommended_dataset_size: 50000,
complexity: ModelComplexity::Complex,
required_qubits: 12,
training_time_estimate: "2-4 hours".to_string(),
performance_notes: "High sensitivity to rare fraud patterns".to_string(),
});
templates.push(TemplateMetadata {
name: "Algorithmic Trading".to_string(),
description: "Quantum reinforcement learning for trading strategies".to_string(),
domain: Domain::Finance,
problem_type: ProblemType::TimeSeriesForecasting,
input_features: vec![
"price_history".to_string(),
"volume".to_string(),
"technical_indicators".to_string(),
"market_sentiment".to_string(),
],
output_description: "Trading signals (buy/sell/hold)".to_string(),
recommended_dataset_size: 100000,
complexity: ModelComplexity::Research,
required_qubits: 16,
training_time_estimate: "4-8 hours".to_string(),
performance_notes: "Potential for discovering novel trading patterns".to_string(),
});
self.templates.insert(Domain::Finance, templates);
}
fn register_chemistry_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Molecular Property Prediction".to_string(),
description: "Quantum graph neural networks for predicting molecular properties"
.to_string(),
domain: Domain::Chemistry,
problem_type: ProblemType::Regression,
input_features: vec![
"molecular_graph".to_string(),
"atom_features".to_string(),
"bond_features".to_string(),
"molecular_descriptors".to_string(),
],
output_description: "Property values (e.g., solubility, toxicity)".to_string(),
recommended_dataset_size: 5000,
complexity: ModelComplexity::Complex,
required_qubits: 12,
training_time_estimate: "2-6 hours".to_string(),
performance_notes: "Superior performance on quantum chemical properties".to_string(),
});
templates.push(TemplateMetadata {
name: "Drug Discovery".to_string(),
description: "VQE-based molecular simulation for drug-target interaction".to_string(),
domain: Domain::Chemistry,
problem_type: ProblemType::BinaryClassification,
input_features: vec![
"drug_structure".to_string(),
"target_structure".to_string(),
"binding_site_features".to_string(),
"pharmacophore_features".to_string(),
],
output_description: "Binding affinity prediction".to_string(),
recommended_dataset_size: 10000,
complexity: ModelComplexity::Research,
required_qubits: 20,
training_time_estimate: "6-12 hours".to_string(),
performance_notes: "Quantum advantage in modeling molecular interactions".to_string(),
});
templates.push(TemplateMetadata {
name: "Catalyst Design".to_string(),
description: "Quantum optimization for catalyst material discovery".to_string(),
domain: Domain::Chemistry,
problem_type: ProblemType::Optimization,
input_features: vec![
"material_composition".to_string(),
"surface_structure".to_string(),
"reaction_conditions".to_string(),
"electronic_properties".to_string(),
],
output_description: "Optimal catalyst structure".to_string(),
recommended_dataset_size: 2000,
complexity: ModelComplexity::Research,
required_qubits: 16,
training_time_estimate: "4-10 hours".to_string(),
performance_notes: "Potential for discovering novel catalysts".to_string(),
});
self.templates.insert(Domain::Chemistry, templates);
}
fn register_healthcare_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Medical Image Analysis".to_string(),
description: "Quantum convolutional networks for medical image classification"
.to_string(),
domain: Domain::Healthcare,
problem_type: ProblemType::MultiClassification,
input_features: vec![
"image_pixels".to_string(),
"image_metadata".to_string(),
"patient_demographics".to_string(),
],
output_description: "Disease classification or severity score".to_string(),
recommended_dataset_size: 20000,
complexity: ModelComplexity::Complex,
required_qubits: 14,
training_time_estimate: "3-8 hours".to_string(),
performance_notes: "Improved accuracy on small datasets".to_string(),
});
templates.push(TemplateMetadata {
name: "Drug Interaction Prediction".to_string(),
description: "Quantum neural networks for predicting drug-drug interactions"
.to_string(),
domain: Domain::Healthcare,
problem_type: ProblemType::BinaryClassification,
input_features: vec![
"drug1_features".to_string(),
"drug2_features".to_string(),
"molecular_similarity".to_string(),
"pathway_information".to_string(),
],
output_description: "Interaction probability and severity".to_string(),
recommended_dataset_size: 15000,
complexity: ModelComplexity::Intermediate,
required_qubits: 10,
training_time_estimate: "1-3 hours".to_string(),
performance_notes: "High sensitivity to rare but dangerous interactions".to_string(),
});
templates.push(TemplateMetadata {
name: "Genomic Analysis".to_string(),
description: "Quantum feature selection for genomic data analysis".to_string(),
domain: Domain::Healthcare,
problem_type: ProblemType::MultiClassification,
input_features: vec![
"snp_data".to_string(),
"gene_expression".to_string(),
"epigenetic_markers".to_string(),
"clinical_phenotypes".to_string(),
],
output_description: "Disease susceptibility prediction".to_string(),
recommended_dataset_size: 5000,
complexity: ModelComplexity::Research,
required_qubits: 18,
training_time_estimate: "4-12 hours".to_string(),
performance_notes: "Effective handling of high-dimensional genomic data".to_string(),
});
self.templates.insert(Domain::Healthcare, templates);
}
fn register_logistics_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Vehicle Routing Optimization".to_string(),
description: "QAOA-based solution for vehicle routing problems".to_string(),
domain: Domain::Logistics,
problem_type: ProblemType::Optimization,
input_features: vec![
"delivery_locations".to_string(),
"distance_matrix".to_string(),
"vehicle_capacity".to_string(),
"time_windows".to_string(),
"traffic_patterns".to_string(),
],
output_description: "Optimal routes for each vehicle".to_string(),
recommended_dataset_size: 1000,
complexity: ModelComplexity::Intermediate,
required_qubits: 12,
training_time_estimate: "30 minutes - 2 hours".to_string(),
performance_notes: "Quantum advantage for complex routing constraints".to_string(),
});
templates.push(TemplateMetadata {
name: "Supply Chain Optimization".to_string(),
description: "Quantum optimization for supply chain network design".to_string(),
domain: Domain::Logistics,
problem_type: ProblemType::Optimization,
input_features: vec![
"supplier_locations".to_string(),
"demand_forecasts".to_string(),
"transportation_costs".to_string(),
"capacity_constraints".to_string(),
"risk_factors".to_string(),
],
output_description: "Optimal supply chain configuration".to_string(),
recommended_dataset_size: 2000,
complexity: ModelComplexity::Complex,
required_qubits: 16,
training_time_estimate: "2-6 hours".to_string(),
performance_notes: "Handles complex multi-objective optimization".to_string(),
});
templates.push(TemplateMetadata {
name: "Inventory Management".to_string(),
description: "Quantum time series forecasting for inventory optimization".to_string(),
domain: Domain::Logistics,
problem_type: ProblemType::TimeSeriesForecasting,
input_features: vec![
"historical_demand".to_string(),
"seasonal_patterns".to_string(),
"economic_indicators".to_string(),
"promotional_events".to_string(),
],
output_description: "Demand forecasts and optimal stock levels".to_string(),
recommended_dataset_size: 10000,
complexity: ModelComplexity::Intermediate,
required_qubits: 8,
training_time_estimate: "1-4 hours".to_string(),
performance_notes: "Improved accuracy in demand prediction".to_string(),
});
self.templates.insert(Domain::Logistics, templates);
}
fn register_energy_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Smart Grid Optimization".to_string(),
description: "Quantum optimization for smart grid energy distribution".to_string(),
domain: Domain::Energy,
problem_type: ProblemType::Optimization,
input_features: vec![
"energy_demand".to_string(),
"renewable_generation".to_string(),
"grid_topology".to_string(),
"storage_capacity".to_string(),
"pricing_signals".to_string(),
],
output_description: "Optimal energy distribution plan".to_string(),
recommended_dataset_size: 5000,
complexity: ModelComplexity::Complex,
required_qubits: 14,
training_time_estimate: "2-6 hours".to_string(),
performance_notes: "Real-time optimization capabilities".to_string(),
});
templates.push(TemplateMetadata {
name: "Renewable Energy Forecasting".to_string(),
description: "Quantum time series models for wind/solar power prediction".to_string(),
domain: Domain::Energy,
problem_type: ProblemType::TimeSeriesForecasting,
input_features: vec![
"weather_data".to_string(),
"historical_generation".to_string(),
"satellite_imagery".to_string(),
"atmospheric_conditions".to_string(),
],
output_description: "Power generation forecasts".to_string(),
recommended_dataset_size: 50000,
complexity: ModelComplexity::Intermediate,
required_qubits: 10,
training_time_estimate: "2-5 hours".to_string(),
performance_notes: "Better handling of weather uncertainty".to_string(),
});
templates.push(TemplateMetadata {
name: "Energy Trading".to_string(),
description: "Quantum reinforcement learning for energy market trading".to_string(),
domain: Domain::Energy,
problem_type: ProblemType::TimeSeriesForecasting,
input_features: vec![
"energy_prices".to_string(),
"demand_patterns".to_string(),
"market_fundamentals".to_string(),
"regulatory_signals".to_string(),
],
output_description: "Trading strategies and price predictions".to_string(),
recommended_dataset_size: 20000,
complexity: ModelComplexity::Research,
required_qubits: 16,
training_time_estimate: "4-10 hours".to_string(),
performance_notes: "Adaptive to rapidly changing market conditions".to_string(),
});
self.templates.insert(Domain::Energy, templates);
}
fn register_materials_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Material Property Prediction".to_string(),
description: "Quantum neural networks for predicting material properties".to_string(),
domain: Domain::Materials,
problem_type: ProblemType::Regression,
input_features: vec![
"crystal_structure".to_string(),
"elemental_composition".to_string(),
"synthesis_conditions".to_string(),
"electronic_structure".to_string(),
],
output_description: "Material properties (conductivity, strength, etc.)".to_string(),
recommended_dataset_size: 8000,
complexity: ModelComplexity::Complex,
required_qubits: 12,
training_time_estimate: "2-6 hours".to_string(),
performance_notes: "Quantum advantage in modeling electronic properties".to_string(),
});
templates.push(TemplateMetadata {
name: "Battery Material Discovery".to_string(),
description: "Quantum optimization for battery electrode materials".to_string(),
domain: Domain::Materials,
problem_type: ProblemType::Optimization,
input_features: vec![
"material_composition".to_string(),
"electrode_structure".to_string(),
"electrolyte_properties".to_string(),
"operating_conditions".to_string(),
],
output_description: "Optimal material composition and structure".to_string(),
recommended_dataset_size: 3000,
complexity: ModelComplexity::Research,
required_qubits: 18,
training_time_estimate: "4-12 hours".to_string(),
performance_notes: "Novel materials discovery potential".to_string(),
});
self.templates.insert(Domain::Materials, templates);
}
fn register_physics_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Particle Physics Event Classification".to_string(),
description: "Quantum neural networks for high-energy physics event classification"
.to_string(),
domain: Domain::Physics,
problem_type: ProblemType::MultiClassification,
input_features: vec![
"detector_hits".to_string(),
"particle_tracks".to_string(),
"energy_deposits".to_string(),
"timing_information".to_string(),
],
output_description: "Event type classification".to_string(),
recommended_dataset_size: 100000,
complexity: ModelComplexity::Research,
required_qubits: 16,
training_time_estimate: "4-12 hours".to_string(),
performance_notes: "Potential quantum advantage in pattern recognition".to_string(),
});
self.templates.insert(Domain::Physics, templates);
}
fn register_nlp_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Quantum Text Classification".to_string(),
description: "Quantum neural networks for text classification tasks".to_string(),
domain: Domain::NLP,
problem_type: ProblemType::MultiClassification,
input_features: vec![
"text_embeddings".to_string(),
"linguistic_features".to_string(),
"semantic_features".to_string(),
],
output_description: "Text category classification".to_string(),
recommended_dataset_size: 25000,
complexity: ModelComplexity::Intermediate,
required_qubits: 10,
training_time_estimate: "2-5 hours".to_string(),
performance_notes: "Effective for small to medium vocabulary".to_string(),
});
self.templates.insert(Domain::NLP, templates);
}
fn register_vision_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Quantum Image Classification".to_string(),
description: "Quantum convolutional networks for image classification".to_string(),
domain: Domain::Vision,
problem_type: ProblemType::MultiClassification,
input_features: vec![
"image_pixels".to_string(),
"texture_features".to_string(),
"edge_features".to_string(),
],
output_description: "Image class prediction".to_string(),
recommended_dataset_size: 30000,
complexity: ModelComplexity::Complex,
required_qubits: 12,
training_time_estimate: "3-8 hours".to_string(),
performance_notes: "Quantum advantage on small image datasets".to_string(),
});
self.templates.insert(Domain::Vision, templates);
}
fn register_security_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Network Intrusion Detection".to_string(),
description: "Quantum anomaly detection for cybersecurity".to_string(),
domain: Domain::Security,
problem_type: ProblemType::AnomalyDetection,
input_features: vec![
"network_traffic".to_string(),
"connection_patterns".to_string(),
"payload_features".to_string(),
"temporal_patterns".to_string(),
],
output_description: "Intrusion probability and attack type".to_string(),
recommended_dataset_size: 40000,
complexity: ModelComplexity::Complex,
required_qubits: 14,
training_time_estimate: "3-7 hours".to_string(),
performance_notes: "High sensitivity to novel attack patterns".to_string(),
});
self.templates.insert(Domain::Security, templates);
}
fn register_climate_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Climate Pattern Recognition".to_string(),
description: "Quantum neural networks for climate pattern analysis".to_string(),
domain: Domain::Climate,
problem_type: ProblemType::TimeSeriesForecasting,
input_features: vec![
"temperature_data".to_string(),
"precipitation_data".to_string(),
"atmospheric_pressure".to_string(),
"ocean_temperatures".to_string(),
],
output_description: "Climate pattern predictions".to_string(),
recommended_dataset_size: 50000,
complexity: ModelComplexity::Research,
required_qubits: 16,
training_time_estimate: "6-15 hours".to_string(),
performance_notes: "Enhanced modeling of complex climate interactions".to_string(),
});
self.templates.insert(Domain::Climate, templates);
}
fn register_aerospace_templates(&mut self) {
let mut templates = Vec::new();
templates.push(TemplateMetadata {
name: "Spacecraft Trajectory Optimization".to_string(),
description: "Quantum optimization for spacecraft trajectory planning".to_string(),
domain: Domain::Aerospace,
problem_type: ProblemType::Optimization,
input_features: vec![
"initial_conditions".to_string(),
"target_orbit".to_string(),
"gravitational_fields".to_string(),
"fuel_constraints".to_string(),
],
output_description: "Optimal trajectory and control inputs".to_string(),
recommended_dataset_size: 1000,
complexity: ModelComplexity::Research,
required_qubits: 20,
training_time_estimate: "2-8 hours".to_string(),
performance_notes: "Potential for discovering novel trajectory solutions".to_string(),
});
self.templates.insert(Domain::Aerospace, templates);
}
pub fn get_domain_templates(&self, domain: &Domain) -> Option<&Vec<TemplateMetadata>> {
self.templates.get(domain)
}
pub fn get_available_domains(&self) -> Vec<Domain> {
self.templates.keys().cloned().collect()
}
pub fn get_template(&self, template_name: &str) -> Result<&TemplateMetadata> {
self.templates
.values()
.flatten()
.find(|t| t.name == template_name)
.ok_or_else(|| {
MLError::InvalidConfiguration(format!("Template not found: {}", template_name))
})
}
pub fn search_by_problem_type(&self, problem_type: &ProblemType) -> Vec<&TemplateMetadata> {
self.templates
.values()
.flatten()
.filter(|template| {
std::mem::discriminant(&template.problem_type)
== std::mem::discriminant(problem_type)
})
.collect()
}
pub fn search_by_complexity(&self, complexity: &ModelComplexity) -> Vec<&TemplateMetadata> {
self.templates
.values()
.flatten()
.filter(|template| {
std::mem::discriminant(&template.complexity) == std::mem::discriminant(complexity)
})
.collect()
}
pub fn search_by_qubits(&self, max_qubits: usize) -> Vec<&TemplateMetadata> {
self.templates
.values()
.flatten()
.filter(|template| template.required_qubits <= max_qubits)
.collect()
}
pub fn recommend_templates(
&self,
domain: Option<&Domain>,
problem_type: Option<&ProblemType>,
max_qubits: Option<usize>,
complexity: Option<&ModelComplexity>,
) -> Vec<&TemplateMetadata> {
let mut candidates: Vec<&TemplateMetadata> = self.templates.values().flatten().collect();
if let Some(domain) = domain {
candidates.retain(|template| &template.domain == domain);
}
if let Some(problem_type) = problem_type {
candidates.retain(|template| {
std::mem::discriminant(&template.problem_type)
== std::mem::discriminant(problem_type)
});
}
if let Some(max_qubits) = max_qubits {
candidates.retain(|template| template.required_qubits <= max_qubits);
}
if let Some(complexity) = complexity {
candidates.retain(|template| {
std::mem::discriminant(&template.complexity) == std::mem::discriminant(complexity)
});
}
candidates.sort_by(|a, b| {
use ModelComplexity::*;
let order_a = match a.complexity {
Simple => 0,
Intermediate => 1,
Complex => 2,
Research => 3,
};
let order_b = match b.complexity {
Simple => 0,
Intermediate => 1,
Complex => 2,
Research => 3,
};
order_a.cmp(&order_b)
});
candidates
}
pub fn create_model_from_template(
&self,
template_name: &str,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
let template = self
.templates
.values()
.flatten()
.find(|t| t.name == template_name)
.ok_or_else(|| {
MLError::InvalidConfiguration(format!("Template not found: {}", template_name))
})?;
match template.domain {
Domain::Finance => self.create_finance_model(template, config),
Domain::Chemistry => self.create_chemistry_model(template, config),
Domain::Healthcare => self.create_healthcare_model(template, config),
Domain::Logistics => self.create_logistics_model(template, config),
Domain::Energy => self.create_energy_model(template, config),
Domain::Materials => self.create_materials_model(template, config),
Domain::Physics => self.create_physics_model(template, config),
Domain::NLP => self.create_nlp_model(template, config),
Domain::Vision => self.create_vision_model(template, config),
Domain::Security => self.create_security_model(template, config),
Domain::Climate => self.create_climate_model(template, config),
Domain::Aerospace => self.create_aerospace_model(template, config),
}
}
fn create_finance_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Portfolio Optimization" => Ok(Box::new(PortfolioOptimizationModel::new(config)?)),
"Credit Risk Assessment" => Ok(Box::new(CreditRiskModel::new(config)?)),
"Fraud Detection" => Ok(Box::new(FraudDetectionModel::new(config)?)),
"Algorithmic Trading" => Ok(Box::new(AlgorithmicTradingModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown finance template: {}",
template.name
))),
}
}
fn create_chemistry_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Molecular Property Prediction" => Ok(Box::new(MolecularPropertyModel::new(config)?)),
"Drug Discovery" => Ok(Box::new(DrugDiscoveryModel::new(config)?)),
"Catalyst Design" => Ok(Box::new(CatalystDesignModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown chemistry template: {}",
template.name
))),
}
}
fn create_healthcare_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Medical Image Analysis" => Ok(Box::new(MedicalImageModel::new(config)?)),
"Drug Interaction Prediction" => Ok(Box::new(DrugInteractionModel::new(config)?)),
"Genomic Analysis" => Ok(Box::new(GenomicAnalysisModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown healthcare template: {}",
template.name
))),
}
}
fn create_logistics_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Vehicle Routing Optimization" => Ok(Box::new(VehicleRoutingModel::new(config)?)),
"Supply Chain Optimization" => Ok(Box::new(SupplyChainModel::new(config)?)),
"Inventory Management" => Ok(Box::new(InventoryManagementModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown logistics template: {}",
template.name
))),
}
}
fn create_energy_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Smart Grid Optimization" => Ok(Box::new(SmartGridModel::new(config)?)),
"Renewable Energy Forecasting" => Ok(Box::new(RenewableEnergyModel::new(config)?)),
"Energy Trading" => Ok(Box::new(EnergyTradingModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown energy template: {}",
template.name
))),
}
}
fn create_materials_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Material Property Prediction" => Ok(Box::new(MaterialPropertyModel::new(config)?)),
"Battery Material Discovery" => Ok(Box::new(BatteryMaterialModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown materials template: {}",
template.name
))),
}
}
fn create_physics_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Particle Physics Event Classification" => {
Ok(Box::new(ParticlePhysicsModel::new(config)?))
}
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown physics template: {}",
template.name
))),
}
}
fn create_nlp_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Quantum Text Classification" => Ok(Box::new(QuantumTextModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown NLP template: {}",
template.name
))),
}
}
fn create_vision_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Quantum Image Classification" => Ok(Box::new(QuantumImageModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown vision template: {}",
template.name
))),
}
}
fn create_security_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Network Intrusion Detection" => Ok(Box::new(IntrusionDetectionModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown security template: {}",
template.name
))),
}
}
fn create_climate_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Climate Pattern Recognition" => Ok(Box::new(ClimatePatternModel::new(config)?)),
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown climate template: {}",
template.name
))),
}
}
fn create_aerospace_model(
&self,
template: &TemplateMetadata,
config: TemplateConfig,
) -> Result<Box<dyn DomainModel>> {
match template.name.as_str() {
"Spacecraft Trajectory Optimization" => {
Ok(Box::new(TrajectoryOptimizationModel::new(config)?))
}
_ => Err(MLError::InvalidConfiguration(format!(
"Unknown aerospace template: {}",
template.name
))),
}
}
}
pub trait DomainModel: Send + Sync {
fn name(&self) -> &str;
fn domain(&self) -> Domain;
fn predict(&self, input: &ArrayD<f64>) -> Result<ArrayD<f64>>;
fn train(&mut self, X: &ArrayD<f64>, y: &ArrayD<f64>) -> Result<()>;
fn config(&self) -> &TemplateConfig;
fn training_suggestions(&self) -> Vec<String>;
fn preprocessing_requirements(&self) -> Vec<String>;
}
pub struct PortfolioOptimizationModel {
config: TemplateConfig,
qaoa_params: Vec<f64>,
}
impl PortfolioOptimizationModel {
pub fn new(config: TemplateConfig) -> Result<Self> {
let qaoa_params = vec![0.5; config.num_qubits * 2]; Ok(Self {
config,
qaoa_params,
})
}
}
impl DomainModel for PortfolioOptimizationModel {
fn name(&self) -> &str {
"Portfolio Optimization"
}
fn domain(&self) -> Domain {
Domain::Finance
}
fn predict(&self, input: &ArrayD<f64>) -> Result<ArrayD<f64>> {
let returns = input.slice(s![..self.config.output_dim]);
let weights = returns.mapv(|x| if x > 0.0 { 1.0 } else { 0.0 });
let normalized_weights = &weights / weights.sum();
Ok(normalized_weights.to_owned().into_dyn())
}
fn train(&mut self, _X: &ArrayD<f64>, _y: &ArrayD<f64>) -> Result<()> {
Ok(())
}
fn config(&self) -> &TemplateConfig {
&self.config
}
fn training_suggestions(&self) -> Vec<String> {
vec![
"Use historical return data with at least 252 trading days".to_string(),
"Include risk-free rate and market volatility data".to_string(),
"Consider transaction costs in the optimization".to_string(),
]
}
fn preprocessing_requirements(&self) -> Vec<String> {
vec![
"Normalize returns to [-1, 1] range".to_string(),
"Remove outliers beyond 3 standard deviations".to_string(),
"Fill missing data with forward fill method".to_string(),
]
}
}
macro_rules! impl_domain_model {
($model_name:ident, $domain:expr, $display_name:expr) => {
pub struct $model_name {
config: TemplateConfig,
}
impl $model_name {
pub fn new(config: TemplateConfig) -> Result<Self> {
Ok(Self { config })
}
}
impl DomainModel for $model_name {
fn name(&self) -> &str {
$display_name
}
fn domain(&self) -> Domain {
$domain
}
fn predict(&self, input: &ArrayD<f64>) -> Result<ArrayD<f64>> {
Ok(ArrayD::zeros(IxDyn(&[self.config.output_dim])))
}
fn train(&mut self, _X: &ArrayD<f64>, _y: &ArrayD<f64>) -> Result<()> {
Ok(())
}
fn config(&self) -> &TemplateConfig {
&self.config
}
fn training_suggestions(&self) -> Vec<String> {
vec!["Domain-specific training suggestions".to_string()]
}
fn preprocessing_requirements(&self) -> Vec<String> {
vec!["Domain-specific preprocessing requirements".to_string()]
}
}
};
}
impl_domain_model!(CreditRiskModel, Domain::Finance, "Credit Risk Assessment");
impl_domain_model!(FraudDetectionModel, Domain::Finance, "Fraud Detection");
impl_domain_model!(
AlgorithmicTradingModel,
Domain::Finance,
"Algorithmic Trading"
);
impl_domain_model!(
MolecularPropertyModel,
Domain::Chemistry,
"Molecular Property Prediction"
);
impl_domain_model!(DrugDiscoveryModel, Domain::Chemistry, "Drug Discovery");
impl_domain_model!(CatalystDesignModel, Domain::Chemistry, "Catalyst Design");
impl_domain_model!(
MedicalImageModel,
Domain::Healthcare,
"Medical Image Analysis"
);
impl_domain_model!(
DrugInteractionModel,
Domain::Healthcare,
"Drug Interaction Prediction"
);
impl_domain_model!(GenomicAnalysisModel, Domain::Healthcare, "Genomic Analysis");
impl_domain_model!(
VehicleRoutingModel,
Domain::Logistics,
"Vehicle Routing Optimization"
);
impl_domain_model!(
SupplyChainModel,
Domain::Logistics,
"Supply Chain Optimization"
);
impl_domain_model!(
InventoryManagementModel,
Domain::Logistics,
"Inventory Management"
);
impl_domain_model!(SmartGridModel, Domain::Energy, "Smart Grid Optimization");
impl_domain_model!(
RenewableEnergyModel,
Domain::Energy,
"Renewable Energy Forecasting"
);
impl_domain_model!(EnergyTradingModel, Domain::Energy, "Energy Trading");
impl_domain_model!(
MaterialPropertyModel,
Domain::Materials,
"Material Property Prediction"
);
impl_domain_model!(
BatteryMaterialModel,
Domain::Materials,
"Battery Material Discovery"
);
impl_domain_model!(
ParticlePhysicsModel,
Domain::Physics,
"Particle Physics Event Classification"
);
impl_domain_model!(QuantumTextModel, Domain::NLP, "Quantum Text Classification");
impl_domain_model!(
QuantumImageModel,
Domain::Vision,
"Quantum Image Classification"
);
impl_domain_model!(
IntrusionDetectionModel,
Domain::Security,
"Network Intrusion Detection"
);
impl_domain_model!(
ClimatePatternModel,
Domain::Climate,
"Climate Pattern Recognition"
);
impl_domain_model!(
TrajectoryOptimizationModel,
Domain::Aerospace,
"Spacecraft Trajectory Optimization"
);
pub mod utils {
use super::*;
pub fn get_default_template_manager() -> DomainTemplateManager {
DomainTemplateManager::new()
}
pub fn print_template_info(template: &TemplateMetadata) {
println!("Template: {}", template.name);
println!("Domain: {:?}", template.domain);
println!("Description: {}", template.description);
println!("Problem Type: {:?}", template.problem_type);
println!("Complexity: {:?}", template.complexity);
println!("Required Qubits: {}", template.required_qubits);
println!("Input Features: {:?}", template.input_features);
println!("Output: {}", template.output_description);
println!(
"Recommended Dataset Size: {}",
template.recommended_dataset_size
);
println!("Training Time: {}", template.training_time_estimate);
println!("Performance Notes: {}", template.performance_notes);
println!();
}
pub fn generate_domain_report(manager: &DomainTemplateManager) -> String {
let mut report = String::new();
report.push_str("Domain Template Report\n");
report.push_str("=====================\n\n");
for domain in manager.get_available_domains() {
if let Some(templates) = manager.get_domain_templates(&domain) {
report.push_str(&format!(
"{:?} Domain ({} templates):\n",
domain,
templates.len()
));
for template in templates {
report.push_str(&format!(
" - {}: {} qubits, {:?} complexity\n",
template.name, template.required_qubits, template.complexity
));
}
report.push_str("\n");
}
}
report
}
pub fn check_template_feasibility(
template: &TemplateMetadata,
available_qubits: usize,
available_time_hours: f64,
) -> (bool, Vec<String>) {
let mut feasible = true;
let mut issues = Vec::new();
if template.required_qubits > available_qubits {
feasible = false;
issues.push(format!(
"Requires {} qubits but only {} available",
template.required_qubits, available_qubits
));
}
let estimated_hours = if template.training_time_estimate.contains("minutes") {
0.5 } else if template.training_time_estimate.contains("hour") {
if template.training_time_estimate.contains("-") {
4.0 } else {
2.0 }
} else {
2.0 };
if estimated_hours > available_time_hours {
issues.push(format!(
"Estimated training time {} exceeds available time {:.1} hours",
template.training_time_estimate, available_time_hours
));
}
(feasible, issues)
}
}
#[cfg(test)]
mod tests {
use super::*;
#[test]
fn test_template_manager_creation() {
let manager = DomainTemplateManager::new();
assert!(!manager.get_available_domains().is_empty());
}
#[test]
fn test_domain_templates() {
let manager = DomainTemplateManager::new();
let finance_templates = manager.get_domain_templates(&Domain::Finance);
assert!(finance_templates.is_some());
assert!(!finance_templates
.expect("finance_templates verified Some above")
.is_empty());
}
#[test]
fn test_template_search() {
let manager = DomainTemplateManager::new();
let classification_templates =
manager.search_by_problem_type(&ProblemType::BinaryClassification);
assert!(!classification_templates.is_empty());
let simple_templates = manager.search_by_complexity(&ModelComplexity::Simple);
let low_qubit_templates = manager.search_by_qubits(8);
assert!(!low_qubit_templates.is_empty());
}
#[test]
fn test_template_recommendations() {
let manager = DomainTemplateManager::new();
let recommendations = manager.recommend_templates(
Some(&Domain::Finance),
Some(&ProblemType::BinaryClassification),
Some(10),
Some(&ModelComplexity::Intermediate),
);
for template in recommendations {
assert_eq!(template.domain, Domain::Finance);
assert!(matches!(
template.problem_type,
ProblemType::BinaryClassification
));
assert!(template.required_qubits <= 10);
}
}
#[test]
fn test_model_creation() {
let manager = DomainTemplateManager::new();
let config = TemplateConfig {
num_qubits: 10,
input_dim: 5,
output_dim: 3,
parameters: HashMap::new(),
};
let model = manager.create_model_from_template("Portfolio Optimization", config);
assert!(model.is_ok());
let model = model.expect("model verified Ok above");
assert_eq!(model.name(), "Portfolio Optimization");
assert_eq!(model.domain(), Domain::Finance);
}
#[test]
fn test_template_feasibility() {
let manager = DomainTemplateManager::new();
let finance_templates = manager
.get_domain_templates(&Domain::Finance)
.expect("Finance domain templates should exist");
let template = &finance_templates[0];
let (feasible, issues) = utils::check_template_feasibility(template, 20, 10.0);
assert!(feasible || !issues.is_empty());
}
}