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Nikola Simidjievski

Publications and source records attributed to Nikola Simidjievski.

At least 19 recordsLinked to original sources

A comprehensive and trustworthy benchmark of AI methods for change detection in Earth observation

Change detection in Earth observation (EO) is critical for monitoring land surface transformations, yet recent research in the field is constrained by inconsistent evaluation protocols and a narrow focus on predictive accuracy without regard for computational efficiency. To address this, we present a standardized, open-source benchmark for evaluating state-of-the-art (SOTA) deep learning methods for Earth observation change detection. We conduct a comprehensive analysis of ten representative model architectures, ranging from convolutional networks (CNNs) to vision transformers (ViTs), across ten heterogeneous change detection datasets. We rigorously evaluate these models with identical experimental protocols, comparing models trained from scratch against those utilizing pre-trained weights. Furthermore, we evaluate predictive performance alongside computational efficiency, including parameter counts and inference latency. Our findings reveal that well-optimized classical architectures, such as Siamese U-Nets, frequently outperform more complex contemporary models when computational efficiency is factored in, and that pre-training consistently provides a significant performance boost with no additional inference cost. To ensure complete transparency and reproducibility, all experimental resources, including standardized data splits, training scripts, training logs, and model checkpoints are publicly available and adhere to FAIR principles (Findable, Accessible, Interoperable, and Reusable).

cs.CV

KnowsTFM: Knowledge-Informed Fine-Tuning of Small Tabular Foundation Models

Tabular foundation models have advanced deep learning for tabular data by delivering strong default performance across many small and medium tasks. Yet in niche domains, where data is scarce, high-dimensional, and shifted from the pretraining distribution, they may still fail to outperform carefully designed domain-specific methods. Many such domains also provide curated relational knowledge in the form of knowledge graphs and knowledge banks, but how to use this knowledge to improve and steer \textit{small} specialist tabular foundation models remains unclear. We address this problem through \textbf{Know}ledge-informed fine-tuning of \textbf{s}mall \textbf{T}abular \textbf{F}oundation \textbf{M}odels (\modelname). Specifically, we study nanoscale TabPFN- and TabICL-style variants, pretrained under controlled synthetic prior families and adapted using two complementary mechanisms: structural attention priors derived from knowledge graphs and parameter-efficient low-rank updates. We show that injecting domain-specific structural knowledge during fine-tuning yields meaningful gains over vanilla variants in specialist settings, whereas gains on general-domain tasks are marginal. We further observe that continual fine-tuning of frontier models can trigger collapse of pretrained knowledge and mechanisms.

cs.LG

Tabular Foundation Model for Generative Modelling

Generative modelling is a demanding test of foundation models, because it requires robust, holistic representation learning for a given data modality, rather than optimisation for a supervised prediction target alone. While recent work on tabular foundation models has achieved remarkable progress in predictive modelling, generative tabular foundation models remain underexplored. Existing tabular foundation generators, in particular, have not yet consistently matched strong dataset-specific generators in synthetic data quality. A key reason is their misalignment with the distinctive causal structural prior of heterogeneous tabular data. In this paper, we address this gap by introducing a novel tabular foundation model, \textbf{TabFORGE}, built on pretrained \textbf{Tab}ular \textbf{FO}undational \textbf{R}epresentations for \textbf{GE}neration. TabFORGE is designed to utilise the implicitly learned causal information underlying diverse tabular datasets in a unified latent space induced by a pretrained causality-aware feature encoder. It further decouples latent modelling from decoding through a two-stage design: we first pretrain a score-based diffusion transformer, and then pretrain a denoising-aligned decoder using the denoised latent embeddings. This design elegantly mitigates the distribution shifts in latent embeddings that typically arise between training and inference. We evaluate TabFORGE comprehensively against 22 benchmark methods on 45 real-world datasets. Our results show that TabFORGE effectively learns and leverages generalisable tabular representations, enabling efficient generation of high-quality synthetic tabular data, particularly with strong structural fidelity.

cs.LG

Towards Spatial Transcriptomics-driven Pathology Foundation Models

Spatial transcriptomics (ST) provides spatially resolved measurements of gene expression, enabling characterization of the molecular landscape of human tissue beyond histological assessment as well as localized readouts that can be aligned with morphology. Concurrently, the success of multimodal foundation models that integrate vision with complementary modalities suggests that morphomolecular coupling between local expression and morphology can be systematically used to improve histological representations themselves. We introduce Spatial Expression-Aligned Learning (SEAL), a vision-omics self-supervised learning framework that infuses localized molecular information into pathology vision encoders. Rather than training new encoders from scratch, SEAL is designed as a parameter-efficient vision-omics finetuning method that can be flexibly applied to widely used pathology foundation models. We instantiate SEAL by training on over 700,000 paired gene expression spot-tissue region examples spanning tumor and normal samples from 14 organs. Tested across 38 slide-level and 15 patch-level downstream tasks, SEAL provides a drop-in replacement for pathology foundation models that consistently improves performance over widely used vision-only and ST prediction baselines on slide-level molecular status, pathway activity, and treatment response prediction, as well as patch-level gene expression prediction tasks. Additionally, SEAL encoders exhibit robust domain generalization on out-of-distribution evaluations and enable new cross-modal capabilities such as gene-to-image retrieval. Our work proposes a general framework for ST-guided finetuning of pathology foundation models, showing that augmenting existing models with localized molecular supervision is an effective and practical step for improving visual representations and expanding their cross-modal utility.

cs.CV

TabStruct: Measuring Structural Fidelity of Tabular Data

Evaluating tabular generators remains a challenging problem, as the unique causal structural prior of heterogeneous tabular data does not lend itself to intuitive human inspection. Recent work has introduced structural fidelity as a tabular-specific evaluation dimension to assess whether synthetic data complies with the causal structures of real data. However, existing benchmarks often neglect the interplay between structural fidelity and conventional evaluation dimensions, thus failing to provide a holistic understanding of model performance. Moreover, they are typically limited to toy datasets, as quantifying existing structural fidelity metrics requires access to ground-truth causal structures, which are rarely available for real-world datasets. In this paper, we propose a novel evaluation framework that jointly considers structural fidelity and conventional evaluation dimensions. We introduce a new evaluation metric, $\textbf{global utility}$, which enables the assessment of structural fidelity even in the absence of ground-truth causal structures. In addition, we present $\textbf{TabStruct}$, a comprehensive evaluation benchmark offering large-scale quantitative analysis on 13 tabular generators from nine distinct categories, across 29 datasets. Our results demonstrate that global utility provides a task-independent, domain-agnostic lens for tabular generator performance. We release the TabStruct benchmark suite, including all datasets, evaluation pipelines, and raw results. Code is available at https://github.com/SilenceX12138/TabStruct.

cs.LG

Multimodal Lego: Model Merging and Fine-Tuning Across Topologies and Modalities in Biomedicine

Learning holistic computational representations in physical, chemical or biological systems requires the ability to process information from different distributions and modalities within the same model. Thus, the demand for multimodal machine learning models has sharply risen for modalities that go beyond vision and language, such as sequences, graphs, time series, or tabular data. While there are many available multimodal fusion and alignment approaches, most of them require end-to-end training, scale quadratically with the number of modalities, cannot handle cases of high modality imbalance in the training set, or are highly topology-specific, making them too restrictive for many biomedical learning tasks. This paper presents Multimodal Lego (MM-Lego), a general-purpose fusion framework to turn any set of encoders into a competitive multimodal model with no or minimal fine-tuning. We achieve this by introducing a wrapper for any unimodal encoder that enforces shape consistency between modality representations. It harmonises these representations by learning features in the frequency domain to enable model merging with little signal interference. We show that MM-Lego 1) can be used as a model merging method which achieves competitive performance with end-to-end fusion models without any fine-tuning, 2) can operate on any unimodal encoder, and 3) is a model fusion method that, with minimal fine-tuning, surpasses all benchmarks in five out of seven datasets.

cs.LG

RO-FIGS: Efficient and Expressive Tree-Based Ensembles for Tabular Data

Tree-based models are often robust to uninformative features and can accurately capture non-smooth, complex decision boundaries. Consequently, they often outperform neural network-based models on tabular datasets at a significantly lower computational cost. Nevertheless, the capability of traditional tree-based ensembles to express complex relationships efficiently is limited by using a single feature to make splits. To improve the efficiency and expressiveness of tree-based methods, we propose Random Oblique Fast Interpretable Greedy-Tree Sums (RO-FIGS). RO-FIGS builds on Fast Interpretable Greedy-Tree Sums, and extends it by learning trees with oblique or multivariate splits, where each split consists of a linear combination learnt from random subsets of features. This helps uncover interactions between features and improves performance. The proposed method is suitable for tabular datasets with both numerical and categorical features. We evaluate RO-FIGS on 22 real-world tabular datasets, demonstrating superior performance and much smaller models over other tree- and neural network-based methods. Additionally, we analyse their splits to reveal valuable insights into feature interactions, enriching the information learnt from SHAP summary plots, and thereby demonstrating the enhanced interpretability of RO-FIGS models. The proposed method is well-suited for applications, where balance between accuracy and interpretability is essential.

cs.LG

How Well Does Your Tabular Generator Learn the Structure of Tabular Data?

Heterogeneous tabular data poses unique challenges in generative modelling due to its fundamentally different underlying data structure compared to homogeneous modalities, such as images and text. Although previous research has sought to adapt the successes of generative modelling in homogeneous modalities to the tabular domain, defining an effective generator for tabular data remains an open problem. One major reason is that the evaluation criteria inherited from other modalities often fail to adequately assess whether tabular generative models effectively capture or utilise the unique structural information encoded in tabular data. In this paper, we carefully examine the limitations of the prevailing evaluation framework and introduce $\textbf{TabStruct}$, a novel evaluation benchmark that positions structural fidelity as a core evaluation dimension. Specifically, TabStruct evaluates the alignment of causal structures in real and synthetic data, providing a direct measure of how effectively tabular generative models learn the structure of tabular data. Through extensive experiments using generators from eight categories on seven datasets with expert-validated causal graphical structures, we show that structural fidelity offers a task-independent, domain-agnostic evaluation dimension. Our findings highlight the importance of tabular data structure and offer practical guidance for developing more effective and robust tabular generative models. Code is available at https://github.com/SilenceX12138/TabStruct.

cs.LG

LLM Embeddings for Deep Learning on Tabular Data

Tabular deep-learning methods require embedding numerical and categorical input features into high-dimensional spaces before processing them. Existing methods deal with this heterogeneous nature of tabular data by employing separate type-specific encoding approaches. This limits the cross-table transfer potential and the exploitation of pre-trained knowledge. We propose a novel approach that first transforms tabular data into text, and then leverages pre-trained representations from LLMs to encode this data, resulting in a plug-and-play solution to improv ing deep-learning tabular methods. We demonstrate that our approach improves accuracy over competitive models, such as MLP, ResNet and FT-Transformer, by validating on seven classification datasets.

cs.LG

Measuring Cross-Modal Interactions in Multimodal Models

Integrating AI in healthcare can greatly improve patient care and system efficiency. However, the lack of explainability in AI systems (XAI) hinders their clinical adoption, especially in multimodal settings that use increasingly complex model architectures. Most existing XAI methods focus on unimodal models, which fail to capture cross-modal interactions crucial for understanding the combined impact of multiple data sources. Existing methods for quantifying cross-modal interactions are limited to two modalities, rely on labelled data, and depend on model performance. This is problematic in healthcare, where XAI must handle multiple data sources and provide individualised explanations. This paper introduces InterSHAP, a cross-modal interaction score that addresses the limitations of existing approaches. InterSHAP uses the Shapley interaction index to precisely separate and quantify the contributions of the individual modalities and their interactions without approximations. By integrating an open-source implementation with the SHAP package, we enhance reproducibility and ease of use. We show that InterSHAP accurately measures the presence of cross-modal interactions, can handle multiple modalities, and provides detailed explanations at a local level for individual samples. Furthermore, we apply InterSHAP to multimodal medical datasets and demonstrate its applicability for individualised explanations.

cs.LG

PATHS: A Hierarchical Transformer for Efficient Whole Slide Image Analysis

Computational analysis of whole slide images (WSIs) has seen significant research progress in recent years, with applications ranging across important diagnostic and prognostic tasks such as survival or cancer subtype prediction. Many state-of-the-art models process the entire slide - which may be as large as $150,000 \times 150,000$ pixels - as a bag of many patches, the size of which necessitates computationally cheap feature aggregation methods. However, a large proportion of these patches are uninformative, such as those containing only healthy or adipose tissue, adding significant noise and size to the bag. We propose Pathology Transformer with Hierarchical Selection (PATHS), a novel top-down method for hierarchical weakly supervised representation learning on slide-level tasks in computational pathology. PATHS is inspired by the cross-magnification manner in which a human pathologist examines a slide, recursively filtering patches at each magnification level to a small subset relevant to the diagnosis. Our method overcomes the complications of processing the entire slide, enabling quadratic self-attention and providing a simple interpretable measure of region importance. We apply PATHS to five datasets of The Cancer Genome Atlas (TCGA), and achieve superior performance on slide-level prediction tasks when compared to previous methods, despite processing only a small proportion of the slide.

cs.CV

TabEBM: A Tabular Data Augmentation Method with Distinct Class-Specific Energy-Based Models

Data collection is often difficult in critical fields such as medicine, physics, and chemistry. As a result, classification methods usually perform poorly with these small datasets, leading to weak predictive performance. Increasing the training set with additional synthetic data, similar to data augmentation in images, is commonly believed to improve downstream classification performance. However, current tabular generative methods that learn either the joint distribution $ p(\mathbf{x}, y) $ or the class-conditional distribution $ p(\mathbf{x} \mid y) $ often overfit on small datasets, resulting in poor-quality synthetic data, usually worsening classification performance compared to using real data alone. To solve these challenges, we introduce TabEBM, a novel class-conditional generative method using Energy-Based Models (EBMs). Unlike existing methods that use a shared model to approximate all class-conditional densities, our key innovation is to create distinct EBM generative models for each class, each modelling its class-specific data distribution individually. This approach creates robust energy landscapes, even in ambiguous class distributions. Our experiments show that TabEBM generates synthetic data with higher quality and better statistical fidelity than existing methods. When used for data augmentation, our synthetic data consistently improves the classification performance across diverse datasets of various sizes, especially small ones. Code is available at https://github.com/andreimargeloiu/TabEBM.

cs.LG

HEALNet: Multimodal Fusion for Heterogeneous Biomedical Data

Technological advances in medical data collection, such as high-throughput genomic sequencing and digital high-resolution histopathology, have contributed to the rising requirement for multimodal biomedical modelling, specifically for image, tabular and graph data. Most multimodal deep learning approaches use modality-specific architectures that are often trained separately and cannot capture the crucial cross-modal information that motivates the integration of different data sources. This paper presents the Hybrid Early-fusion Attention Learning Network (HEALNet): a flexible multimodal fusion architecture, which a) preserves modality-specific structural information, b) captures the cross-modal interactions and structural information in a shared latent space, c) can effectively handle missing modalities during training and inference, and d) enables intuitive model inspection by learning on the raw data input instead of opaque embeddings. We conduct multimodal survival analysis on Whole Slide Images and Multi-omic data on four cancer datasets from The Cancer Genome Atlas (TCGA). HEALNet achieves state-of-the-art performance compared to other end-to-end trained fusion models, substantially improving over unimodal and multimodal baselines whilst being robust in scenarios with missing modalities.

cs.LG

GCondNet: A Novel Method for Improving Neural Networks on Small High-Dimensional Tabular Data

Neural networks often struggle with high-dimensional but small sample-size tabular datasets. One reason is that current weight initialisation methods assume independence between weights, which can be problematic when there are insufficient samples to estimate the model's parameters accurately. In such small data scenarios, leveraging additional structures can improve the model's performance and training stability. To address this, we propose GCondNet, a general approach to enhance neural networks by leveraging implicit structures present in tabular data. We create a graph between samples for each data dimension, and utilise Graph Neural Networks (GNNs) to extract this implicit structure, and for conditioning the parameters of the first layer of an underlying predictor network. By creating many small graphs, GCondNet exploits the data's high-dimensionality, and thus improves the performance of an underlying predictor network. We demonstrate GCondNet's effectiveness on 12 real-world datasets, where it outperforms 14 standard and state-of-the-art methods. The results show that GCondNet is a versatile framework for injecting graph-regularisation into various types of neural networks, including MLPs and tabular Transformers. Code is available at https://github.com/andreimargeloiu/GCondNet.

cs.LG

TabMDA: Tabular Manifold Data Augmentation for Any Classifier using Transformers with In-context Subsetting

Tabular data is prevalent in many critical domains, yet it is often challenging to acquire in large quantities. This scarcity usually results in poor performance of machine learning models on such data. Data augmentation, a common strategy for performance improvement in vision and language tasks, typically underperforms for tabular data due to the lack of explicit symmetries in the input space. To overcome this challenge, we introduce TabMDA, a novel method for manifold data augmentation on tabular data. This method utilises a pre-trained in-context model, such as TabPFN, to map the data into an embedding space. TabMDA performs label-invariant transformations by encoding the data multiple times with varied contexts. This process explores the learned embedding space of the underlying in-context models, thereby enlarging the training dataset. TabMDA is a training-free method, making it applicable to any classifier. We evaluate TabMDA on five standard classifiers and observe significant performance improvements across various tabular datasets. Our results demonstrate that TabMDA provides an effective way to leverage information from pre-trained in-context models to enhance the performance of downstream classifiers. Code is available at https://github.com/AdrianBZG/TabMDA.

cs.LG

ProtoGate: Prototype-based Neural Networks with Global-to-local Feature Selection for Tabular Biomedical Data

Tabular biomedical data poses challenges in machine learning because it is often high-dimensional and typically low-sample-size (HDLSS). Previous research has attempted to address these challenges via local feature selection, but existing approaches often fail to achieve optimal performance due to their limitation in identifying globally important features and their susceptibility to the co-adaptation problem. In this paper, we propose ProtoGate, a prototype-based neural model for feature selection on HDLSS data. ProtoGate first selects instance-wise features via adaptively balancing global and local feature selection. Furthermore, ProtoGate employs a non-parametric prototype-based prediction mechanism to tackle the co-adaptation problem, ensuring the feature selection results and predictions are consistent with underlying data clusters. We conduct comprehensive experiments to evaluate the performance and interpretability of ProtoGate on synthetic and real-world datasets. The results show that ProtoGate generally outperforms state-of-the-art methods in prediction accuracy by a clear margin while providing high-fidelity feature selection and explainable predictions. Code is available at https://github.com/SilenceX12138/ProtoGate.

cs.LG

Sample size determination via learning-type curves

This paper is concerned with sample size determination methodology for prediction models. We propose combining the individual calculations via a learning-type curve. We suggest two distinct ways of doing so, a deterministic skeleton of a learning curve and a Gaussian process centred upon its deterministic counterpart. We employ several learning algorithms for modelling the primary endpoint and distinct measures for trial efficacy. We find that the performance may vary with the sample size, but borrowing information across sample size universally improves the performance of such calculations. The Gaussian process-based learning curve appears more robust and statistically efficient, while computational efficiency is comparable. We suggest that anchoring against historical evidence when extrapolating sample sizes should be adopted when such data are available. The methods are illustrated on binary and survival endpoints.

stat.ME

In-Domain Self-Supervised Learning Improves Remote Sensing Image Scene Classification

We investigate the utility of in-domain self-supervised pre-training of vision models in the analysis of remote sensing imagery. Self-supervised learning (SSL) has emerged as a promising approach for remote sensing image classification due to its ability to exploit large amounts of unlabeled data. Unlike traditional supervised learning, SSL aims to learn representations of data without the need for explicit labels. This is achieved by formulating auxiliary tasks that can be used for pre-training models before fine-tuning them on a given downstream task. A common approach in practice to SSL pre-training is utilizing standard pre-training datasets, such as ImageNet. While relevant, such a general approach can have a sub-optimal influence on the downstream performance of models, especially on tasks from challenging domains such as remote sensing. In this paper, we analyze the effectiveness of SSL pre-training by employing the iBOT framework coupled with Vision transformers trained on Million-AID, a large and unlabeled remote sensing dataset. We present a comprehensive study of different self-supervised pre-training strategies and evaluate their effect across 14 downstream datasets with diverse properties. Our results demonstrate that leveraging large in-domain datasets for self-supervised pre-training consistently leads to improved predictive downstream performance, compared to the standard approaches found in practice.

cs.CV