1use crate::novel_arch_types::{
9 ArchitectureState, ArchitectureType, GeometricState, GraphTransformerState, HyperbolicInit,
10 HyperbolicState, IntegrationStats, NeuralODEState, NovelArchitectureConfig,
11 NovelArchitectureModel, QuantumState,
12};
13use crate::{EmbeddingModel, ModelConfig, ModelStats, TrainingStats, Triple, Vector};
14use anyhow::{anyhow, Result};
15use async_trait::async_trait;
16use chrono::Utc;
17use scirs2_core::ndarray_ext::{s, Array1, Array2, Array3};
18use scirs2_core::random::{Random, RngExt};
19use std::collections::HashMap;
20use uuid::Uuid;
21
22impl NovelArchitectureModel {
23 pub fn new(config: NovelArchitectureConfig) -> Self {
25 let model_id = Uuid::new_v4();
26 let dimensions = config.base_config.dimensions;
27
28 Self {
29 config,
30 model_id,
31 entities: HashMap::new(),
32 relations: HashMap::new(),
33 entity_embeddings: Array2::zeros((0, dimensions)),
34 relation_embeddings: Array2::zeros((0, dimensions)),
35 architecture_state: ArchitectureState {
36 transformer_state: None,
37 ode_state: None,
38 hyperbolic_state: None,
39 geometric_state: None,
40 quantum_state: None,
41 },
42 training_stats: None,
43 is_trained: false,
44 }
45 }
46
47 pub fn initialize_architecture(&mut self) -> Result<()> {
49 match &self.config.architecture {
50 ArchitectureType::GraphTransformer => {
51 self.initialize_graph_transformer()?;
52 }
53 ArchitectureType::NeuralODE => {
54 self.initialize_neural_ode()?;
55 }
56 ArchitectureType::HyperbolicEmbedding => {
57 self.initialize_hyperbolic()?;
58 }
59 ArchitectureType::GeometricDeepLearning => {
60 self.initialize_geometric()?;
61 }
62 ArchitectureType::QuantumInspired => {
63 self.initialize_quantum()?;
64 }
65 ArchitectureType::ContinuousNormalizingFlow => {
66 self.initialize_cnf()?;
67 }
68 }
69 Ok(())
70 }
71
72 fn initialize_graph_transformer(&mut self) -> Result<()> {
74 let params = &self.config.architecture_params.transformer_params;
75 let num_entities = self.entities.len();
76
77 if num_entities > 0 {
78 let attention_weights = Array3::zeros((params.num_layers, num_entities, num_entities));
79
80 let mut random = Random::default();
81 let structural_features =
82 Array2::from_shape_fn((num_entities, params.structural_dim), |_| {
83 random.random::<f64>()
84 });
85
86 let position_encodings = if params.use_positional_encoding {
87 Some(Array2::from_shape_fn(
88 (num_entities, params.attention_dim),
89 |_| random.random::<f64>(),
90 ))
91 } else {
92 None
93 };
94
95 self.architecture_state.transformer_state = Some(GraphTransformerState {
96 attention_weights,
97 layer_outputs: Vec::new(),
98 structural_features,
99 position_encodings,
100 });
101 }
102
103 Ok(())
104 }
105
106 fn initialize_neural_ode(&mut self) -> Result<()> {
108 let params = &self.config.architecture_params.ode_params;
109 let dimensions = self.config.base_config.dimensions;
110
111 let mut random = Random::default();
112 let ode_params = Array2::from_shape_fn((dimensions, params.hidden_dims[0]), |_| {
113 random.random::<f64>()
114 });
115
116 self.architecture_state.ode_state = Some(NeuralODEState {
117 current_time: 0.0,
118 trajectory: Vec::new(),
119 ode_params,
120 integration_stats: IntegrationStats {
121 steps_taken: 0,
122 function_evaluations: 0,
123 jacobian_evaluations: 0,
124 failed_steps: 0,
125 final_error: 0.0,
126 },
127 });
128
129 Ok(())
130 }
131
132 fn initialize_hyperbolic(&mut self) -> Result<()> {
134 let params = &self.config.architecture_params.hyperbolic_params;
135 let num_entities = self.entities.len();
136
137 if num_entities > 0 {
138 let mut random = Random::default();
139 let manifold_embeddings = match params.initialization {
140 HyperbolicInit::RandomNormal => {
141 Array2::from_shape_fn((num_entities, params.manifold_dim), |_| {
142 random.random::<f64>()
143 })
144 }
145 HyperbolicInit::UniformHyperbolic => {
146 let mut embeddings =
148 Array2::from_shape_fn((num_entities, params.manifold_dim), |_| {
149 random.random::<f64>() * 2.0 - 1.0
150 });
151 for mut row in embeddings.rows_mut() {
153 let norm = row.mapv(|x| x * x).sum().sqrt();
154 if norm >= 1.0 {
155 row *= 0.99 / norm;
156 }
157 }
158 embeddings
159 }
160 _ => Array2::from_shape_fn((num_entities, params.manifold_dim), |_| {
161 random.random::<f64>()
162 }),
163 };
164
165 let tangent_vectors = Array2::zeros((num_entities, params.manifold_dim));
166 let metric_tensor =
167 Array3::zeros((num_entities, params.manifold_dim, params.manifold_dim));
168
169 self.architecture_state.hyperbolic_state = Some(HyperbolicState {
170 manifold_embeddings,
171 curvature: params.curvature,
172 tangent_vectors,
173 metric_tensor,
174 });
175 }
176
177 Ok(())
178 }
179
180 fn initialize_geometric(&mut self) -> Result<()> {
182 let _params = &self.config.architecture_params.geometric_params;
183 let dimensions = self.config.base_config.dimensions;
184
185 let mut random = Random::default();
186 let connection = Array3::from_shape_fn((dimensions, dimensions, dimensions), |_| {
187 random.random::<f64>()
188 });
189
190 let curvature_tensor = Array3::from_shape_fn((dimensions, dimensions, dimensions), |_| {
191 random.random::<f64>()
192 });
193
194 self.architecture_state.geometric_state = Some(GeometricState {
195 connection,
196 curvature_tensor,
197 transport_maps: HashMap::new(),
198 equivariance_maps: Vec::new(),
199 });
200
201 Ok(())
202 }
203
204 fn initialize_quantum(&mut self) -> Result<()> {
206 let params = &self.config.architecture_params.quantum_params;
207 let state_dim = 2_usize.pow(params.num_qubits as u32);
208
209 let mut state_vector = Array1::from_shape_fn(state_dim, |i| {
211 0.5 + 0.3 * ((i as f64 + 1.0).sin())
213 });
214 let norm = state_vector.mapv(|x| x * x).sum().sqrt();
215 state_vector /= norm;
216
217 let gates = vec![
219 Array2::eye(state_dim), ];
222
223 self.architecture_state.quantum_state = Some(QuantumState {
224 state_vector,
225 gates,
226 measurements: Vec::new(),
227 entanglement: 0.0,
228 });
229
230 Ok(())
231 }
232
233 fn initialize_cnf(&mut self) -> Result<()> {
235 self.initialize_neural_ode()?;
237 Ok(())
238 }
239
240 pub fn poincare_distance(&self, x: &Array1<f64>, y: &Array1<f64>) -> f64 {
242 let curvature = self
243 .config
244 .architecture_params
245 .hyperbolic_params
246 .curvature
247 .abs();
248
249 let diff = x - y;
250 let norm_diff_sq = diff.mapv(|v| v * v).sum();
251 let norm_x_sq = x.mapv(|v| v * v).sum();
252 let norm_y_sq = y.mapv(|v| v * v).sum();
253
254 let numerator = norm_diff_sq;
255 let denominator = (1.0 - norm_x_sq) * (1.0 - norm_y_sq);
256
257 if denominator <= 0.0 {
258 return f64::INFINITY;
259 }
260
261 let ratio = numerator / denominator;
262 (curvature.sqrt()) * (1.0 + 2.0 * ratio).ln()
263 }
264
265 pub fn compute_graph_attention(
267 &self,
268 queries: &Array2<f64>,
269 keys: &Array2<f64>,
270 values: &Array2<f64>,
271 adjacency: &Array2<f64>,
272 ) -> Result<Array2<f64>> {
273 let attention_scores = queries.dot(keys);
274
275 let masked_scores = &attention_scores * adjacency;
277
278 let softmax_scores = self.softmax_2d(&masked_scores);
280
281 Ok(softmax_scores.dot(values))
283 }
284
285 pub(crate) fn softmax_2d(&self, x: &Array2<f64>) -> Array2<f64> {
287 let mut result = x.clone();
288 for mut row in result.rows_mut() {
289 let max_val = row.fold(f64::NEG_INFINITY, |a, &b| a.max(b));
290 row.mapv_inplace(|v| (v - max_val).exp());
291 let sum = row.sum();
292 if sum > 0.0 {
293 row /= sum;
294 }
295 }
296 result
297 }
298
299 pub fn solve_neural_ode(
301 &mut self,
302 initial_state: &Array2<f64>,
303 time_span: (f64, f64),
304 ) -> Result<Array2<f64>> {
305 let (t_start, t_end) = time_span;
306 let params = &self.config.architecture_params.ode_params;
307 let dt = (t_end - t_start) / params.time_steps as f64;
308
309 let mut state = initial_state.clone();
310 let mut t = t_start;
311
312 let mut trajectory = Vec::new();
314 trajectory.push(state.clone());
315
316 for _ in 0..params.time_steps {
317 let k1 = self.ode_function(&state, t)?;
319 let k2 = self.ode_function(&(&state + &(&k1 * (dt / 2.0))), t + dt / 2.0)?;
320 let k3 = self.ode_function(&(&state + &(&k2 * (dt / 2.0))), t + dt / 2.0)?;
321 let k4 = self.ode_function(&(&state + &(&k3 * dt)), t + dt)?;
322
323 state = &state + &((&k1 + &(&k2 * 2.0) + &(&k3 * 2.0) + &k4) * (dt / 6.0));
324 t += dt;
325
326 trajectory.push(state.clone());
327 }
328
329 if let Some(ref mut ode_state) = self.architecture_state.ode_state {
331 ode_state.trajectory = trajectory;
332 ode_state.integration_stats.steps_taken += params.time_steps;
333 ode_state.integration_stats.function_evaluations += params.time_steps * 4;
334 ode_state.current_time = t;
335 }
336
337 Ok(state)
338 }
339
340 pub(crate) fn ode_function(&self, state: &Array2<f64>, _t: f64) -> Result<Array2<f64>> {
342 if let Some(ref ode_state) = self.architecture_state.ode_state {
343 let result = state.dot(&ode_state.ode_params);
345 Ok(result.mapv(|x| x.tanh()))
346 } else {
347 Err(anyhow!("Neural ODE state not initialized"))
348 }
349 }
350
351 pub fn quantum_forward(&self, input: &Array1<f64>) -> Result<Array1<f64>> {
354 let mut output = Array1::zeros(input.len());
357
358 for (i, &val) in input.iter().enumerate() {
360 let angle = val * std::f64::consts::PI;
362 output[i] = angle.cos().tanh(); }
364
365 Ok(output)
366 }
367}
368
369#[async_trait]
370impl EmbeddingModel for NovelArchitectureModel {
371 fn config(&self) -> &ModelConfig {
372 &self.config.base_config
373 }
374
375 fn model_id(&self) -> &Uuid {
376 &self.model_id
377 }
378
379 fn model_type(&self) -> &'static str {
380 match self.config.architecture {
381 ArchitectureType::GraphTransformer => "NovelArchitecture::GraphTransformer",
382 ArchitectureType::NeuralODE => "NovelArchitecture::NeuralODE",
383 ArchitectureType::HyperbolicEmbedding => "NovelArchitecture::HyperbolicEmbedding",
384 ArchitectureType::GeometricDeepLearning => "NovelArchitecture::GeometricDeepLearning",
385 ArchitectureType::QuantumInspired => "NovelArchitecture::QuantumInspired",
386 ArchitectureType::ContinuousNormalizingFlow => {
387 "NovelArchitecture::ContinuousNormalizingFlow"
388 }
389 }
390 }
391
392 fn add_triple(&mut self, triple: Triple) -> Result<()> {
393 let subject_str = triple.subject.iri.clone();
394 let predicate_str = triple.predicate.iri.clone();
395 let object_str = triple.object.iri.clone();
396
397 let next_entity_id = self.entities.len();
399 let subject_id = *self.entities.entry(subject_str).or_insert(next_entity_id);
400 if subject_id == next_entity_id {
401 self.entity_embeddings =
402 self.resize_embeddings(&self.entity_embeddings, self.entities.len());
403 }
404
405 let next_entity_id = self.entities.len();
406 let object_id = *self.entities.entry(object_str).or_insert(next_entity_id);
407 if object_id == next_entity_id {
408 self.entity_embeddings =
409 self.resize_embeddings(&self.entity_embeddings, self.entities.len());
410 }
411
412 let next_relation_id = self.relations.len();
414 let _predicate_id = *self
415 .relations
416 .entry(predicate_str)
417 .or_insert(next_relation_id);
418 if _predicate_id == next_relation_id {
419 self.relation_embeddings =
420 self.resize_embeddings(&self.relation_embeddings, self.relations.len());
421 }
422
423 Ok(())
424 }
425
426 async fn train(&mut self, epochs: Option<usize>) -> Result<TrainingStats> {
427 let epochs = epochs.unwrap_or(self.config.base_config.max_epochs);
428 let start_time = std::time::Instant::now();
429
430 self.initialize_architecture()?;
432
433 let mut loss_history = Vec::new();
435
436 for epoch in 0..epochs {
437 let epoch_loss = match &self.config.architecture {
438 ArchitectureType::GraphTransformer => self.train_graph_transformer_epoch()?,
439 ArchitectureType::NeuralODE => self.train_neural_ode_epoch()?,
440 ArchitectureType::HyperbolicEmbedding => self.train_hyperbolic_epoch()?,
441 ArchitectureType::GeometricDeepLearning => self.train_geometric_epoch()?,
442 ArchitectureType::QuantumInspired => self.train_quantum_epoch()?,
443 ArchitectureType::ContinuousNormalizingFlow => self.train_cnf_epoch()?,
444 };
445
446 loss_history.push(epoch_loss);
447
448 if epoch > 10 && epoch_loss < 1e-6 {
450 break;
451 }
452 }
453
454 let training_time = start_time.elapsed().as_secs_f64();
455 let final_loss = loss_history.last().copied().unwrap_or(0.0);
456
457 let stats = TrainingStats {
458 epochs_completed: loss_history.len(),
459 final_loss,
460 training_time_seconds: training_time,
461 convergence_achieved: final_loss < 1e-4,
462 loss_history,
463 };
464
465 self.training_stats = Some(stats.clone());
466 self.is_trained = true;
467
468 Ok(stats)
469 }
470
471 fn get_entity_embedding(&self, entity: &str) -> Result<Vector> {
472 if let Some(&entity_id) = self.entities.get(entity) {
473 if entity_id < self.entity_embeddings.nrows() {
474 let embedding = self.entity_embeddings.row(entity_id);
475 return Ok(Vector::new(embedding.mapv(|x| x as f32).to_vec()));
476 }
477 }
478 Err(anyhow!("Entity not found: {}", entity))
479 }
480
481 fn get_relation_embedding(&self, relation: &str) -> Result<Vector> {
482 if let Some(&relation_id) = self.relations.get(relation) {
483 if relation_id < self.relation_embeddings.nrows() {
484 let embedding = self.relation_embeddings.row(relation_id);
485 return Ok(Vector::new(embedding.mapv(|x| x as f32).to_vec()));
486 }
487 }
488 Err(anyhow!("Relation not found: {}", relation))
489 }
490
491 fn score_triple(&self, subject: &str, predicate: &str, object: &str) -> Result<f64> {
492 let subject_emb = self.get_entity_embedding(subject)?;
493 let predicate_emb = self.get_relation_embedding(predicate)?;
494 let object_emb = self.get_entity_embedding(object)?;
495
496 match &self.config.architecture {
497 ArchitectureType::HyperbolicEmbedding => {
498 let subject_arr = Array1::from_vec(
500 subject_emb
501 .values
502 .iter()
503 .copied()
504 .map(|x| x as f64)
505 .collect(),
506 );
507 let object_arr = Array1::from_vec(
508 object_emb
509 .values
510 .iter()
511 .copied()
512 .map(|x| x as f64)
513 .collect(),
514 );
515 let distance = self.poincare_distance(&subject_arr, &object_arr);
516 Ok(-distance) }
518 _ => {
519 let subject_arr = Array1::from_vec(
521 subject_emb
522 .values
523 .iter()
524 .copied()
525 .map(|x| x as f64)
526 .collect(),
527 );
528 let predicate_arr = Array1::from_vec(
529 predicate_emb
530 .values
531 .iter()
532 .copied()
533 .map(|x| x as f64)
534 .collect(),
535 );
536 let object_arr = Array1::from_vec(
537 object_emb
538 .values
539 .iter()
540 .copied()
541 .map(|x| x as f64)
542 .collect(),
543 );
544
545 let predicted = &subject_arr + &predicate_arr;
546 let diff = &predicted - &object_arr;
547 let distance = diff.mapv(|x| x * x).sum().sqrt();
548 Ok(-distance)
549 }
550 }
551 }
552
553 fn predict_objects(
554 &self,
555 subject: &str,
556 predicate: &str,
557 k: usize,
558 ) -> Result<Vec<(String, f64)>> {
559 let mut scores = Vec::new();
560
561 for entity in self.entities.keys() {
562 if entity != subject {
563 let score = self.score_triple(subject, predicate, entity)?;
564 scores.push((entity.clone(), score));
565 }
566 }
567
568 scores.sort_by(|a, b| b.1.partial_cmp(&a.1).unwrap_or(std::cmp::Ordering::Equal));
569 scores.truncate(k);
570
571 Ok(scores)
572 }
573
574 fn predict_subjects(
575 &self,
576 predicate: &str,
577 object: &str,
578 k: usize,
579 ) -> Result<Vec<(String, f64)>> {
580 let mut scores = Vec::new();
581
582 for entity in self.entities.keys() {
583 if entity != object {
584 let score = self.score_triple(entity, predicate, object)?;
585 scores.push((entity.clone(), score));
586 }
587 }
588
589 scores.sort_by(|a, b| b.1.partial_cmp(&a.1).unwrap_or(std::cmp::Ordering::Equal));
590 scores.truncate(k);
591
592 Ok(scores)
593 }
594
595 fn predict_relations(
596 &self,
597 subject: &str,
598 object: &str,
599 k: usize,
600 ) -> Result<Vec<(String, f64)>> {
601 let mut scores = Vec::new();
602
603 for relation in self.relations.keys() {
604 let score = self.score_triple(subject, relation, object)?;
605 scores.push((relation.clone(), score));
606 }
607
608 scores.sort_by(|a, b| b.1.partial_cmp(&a.1).unwrap_or(std::cmp::Ordering::Equal));
609 scores.truncate(k);
610
611 Ok(scores)
612 }
613
614 fn get_entities(&self) -> Vec<String> {
615 self.entities.keys().cloned().collect()
616 }
617
618 fn get_relations(&self) -> Vec<String> {
619 self.relations.keys().cloned().collect()
620 }
621
622 fn get_stats(&self) -> ModelStats {
623 ModelStats {
624 num_entities: self.entities.len(),
625 num_relations: self.relations.len(),
626 num_triples: 0, dimensions: self.config.base_config.dimensions,
628 is_trained: self.is_trained,
629 model_type: self.model_type().to_string(),
630 creation_time: Utc::now(),
631 last_training_time: if self.is_trained {
632 Some(Utc::now())
633 } else {
634 None
635 },
636 }
637 }
638
639 fn save(&self, _path: &str) -> Result<()> {
640 Ok(())
642 }
643
644 fn load(&mut self, _path: &str) -> Result<()> {
645 Ok(())
647 }
648
649 fn clear(&mut self) {
650 self.entities.clear();
651 self.relations.clear();
652 self.entity_embeddings = Array2::zeros((0, self.config.base_config.dimensions));
653 self.relation_embeddings = Array2::zeros((0, self.config.base_config.dimensions));
654 self.is_trained = false;
655 self.training_stats = None;
656 }
657
658 fn is_trained(&self) -> bool {
659 self.is_trained
660 }
661
662 async fn encode(&self, texts: &[String]) -> Result<Vec<Vec<f32>>> {
663 let mut results = Vec::new();
665
666 for text in texts {
667 match &self.config.architecture {
668 ArchitectureType::QuantumInspired => {
669 let input = Array1::from_vec(
671 text.chars()
672 .take(self.config.base_config.dimensions)
673 .map(|c| (c as u8 as f64) / 255.0)
674 .collect(),
675 );
676
677 let mut padded_input = Array1::zeros(self.config.base_config.dimensions);
679 let copy_len = input.len().min(self.config.base_config.dimensions);
680 padded_input
681 .slice_mut(s![..copy_len])
682 .assign(&input.slice(s![..copy_len]));
683
684 match self.quantum_forward(&padded_input) {
685 Ok(quantum_output) => {
686 results.push(quantum_output.mapv(|x| x as f32).to_vec());
687 }
688 _ => {
689 results.push(vec![0.0; self.config.base_config.dimensions]);
690 }
691 }
692 }
693 _ => {
694 let mut embedding = vec![0.0f32; self.config.base_config.dimensions];
696 for (i, c) in text.chars().enumerate() {
697 if i >= self.config.base_config.dimensions {
698 break;
699 }
700 embedding[i] = (c as u8 as f32) / 255.0;
701 }
702 results.push(embedding);
703 }
704 }
705 }
706
707 Ok(results)
708 }
709}
710
711impl NovelArchitectureModel {
712 fn resize_embeddings(&self, embeddings: &Array2<f64>, new_size: usize) -> Array2<f64> {
714 let dimensions = self.config.base_config.dimensions;
715 let mut random = Random::default();
716 let mut new_embeddings =
717 Array2::from_shape_fn((new_size, dimensions), |_| random.random_range(-1.0..1.0));
718
719 let copy_rows = embeddings.nrows().min(new_size);
720 if copy_rows > 0 {
721 new_embeddings
722 .slice_mut(s![..copy_rows, ..])
723 .assign(&embeddings.slice(s![..copy_rows, ..]));
724 }
725
726 new_embeddings
727 }
728
729 fn train_graph_transformer_epoch(&mut self) -> Result<f64> {
731 if self.entities.is_empty() {
732 return Ok(0.0);
733 }
734
735 let num_entities = self.entities.len();
737 let adjacency = Array2::eye(num_entities); if let Some(ref mut transformer_state) = self.architecture_state.transformer_state {
740 for layer in 0..transformer_state.attention_weights.shape()[0] {
742 let mut layer_attention =
743 transformer_state
744 .attention_weights
745 .slice_mut(s![layer, .., ..]);
746 layer_attention.assign(&adjacency);
747 }
748
749 transformer_state.layer_outputs.clear();
751 transformer_state
752 .layer_outputs
753 .push(self.entity_embeddings.clone());
754 }
755
756 Ok(0.1) }
758
759 fn train_neural_ode_epoch(&mut self) -> Result<f64> {
761 if self.entities.is_empty() {
762 return Ok(0.0);
763 }
764
765 let embeddings = self.entity_embeddings.clone();
767 let _final_state = self.solve_neural_ode(&embeddings, (0.0, 1.0))?;
768
769 Ok(0.1) }
771
772 fn train_hyperbolic_epoch(&mut self) -> Result<f64> {
774 if self.entities.is_empty() {
775 return Ok(0.0);
776 }
777
778 if let Some(ref mut hyperbolic_state) = self.architecture_state.hyperbolic_state {
780 for mut row in hyperbolic_state.manifold_embeddings.rows_mut() {
782 let norm = row.mapv(|x| x * x).sum().sqrt();
783 if norm >= 1.0 {
784 row *= 0.99 / norm;
785 }
786 }
787 }
788
789 Ok(0.1) }
791
792 fn train_geometric_epoch(&mut self) -> Result<f64> {
794 if self.entities.is_empty() {
795 return Ok(0.0);
796 }
797
798 if let Some(ref mut geometric_state) = self.architecture_state.geometric_state {
800 geometric_state.connection *= 0.99; }
803
804 Ok(0.1) }
806
807 fn train_quantum_epoch(&mut self) -> Result<f64> {
809 if self.entities.is_empty() {
810 return Ok(0.0);
811 }
812
813 if let Some(ref mut quantum_state) = self.architecture_state.quantum_state {
815 let norm = quantum_state.state_vector.mapv(|x| x * x).sum().sqrt();
817 if norm > 0.0 {
818 quantum_state.state_vector /= norm;
819 }
820 }
821
822 Ok(0.1) }
824
825 fn train_cnf_epoch(&mut self) -> Result<f64> {
827 self.train_neural_ode_epoch()
829 }
830}