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Philippe Meyer

Publications and source records attributed to Philippe Meyer.

14 recordsLinked to original sources

An Agentic Retrobiosynthesis Framework with Learned Frontier Selection

Large language models are increasingly used as agents for multistep retrosynthesis, raising the question of how much their search policy contributes independently of the underlying reaction model. We investigate this question in a biological setting through rule-based retrobiosynthesis: a deterministic biochemical engine generates the same validated transitions for every method, searching for routes that terminate in metabolites available to an \emph{Escherichia coli} chassis, while the policy only selects which frontier molecule to expand next. Prompted and LoRA-tuned Qwen2.5-7B policies use a strict choice-only interface. The fine-tuned policy reaches $65\pm1$\% solve rate at 10 expansions on LASER versus 59\% for MCTS, and at 200 expansions reaches $78\pm1$\% versus 75\% on LASER, $88\pm3$\% versus 80\% on the RetroPath RL Golden benchmark, and $63\pm2$\% versus 45\% on the BioNavi-NP benchmark. Fine-tuning also consistently outperforms direct prompting. These results show that route-supervised frontier selection can improve budgeted search without altering biochemical generation, although performance remains dependent on frontier construction and reaction ranking.

cs.CL

Rethinking Post-Hoc Calibration in Semantic Segmentation

Reliable confidence estimates are essential in semantic segmentation, especially in safety-critical settings where overconfident errors can mislead downstream decisions. Yet modern segmentation models often remain miscalibrated. Post-hoc calibration offers a practical way to correct confidence estimates without retraining the segmentation model, but its use in dense prediction raises structural issues that are often overlooked. We study two such issues. First, adding a constant to all logits leaves the softmax probabilities unchanged, but several standard calibrators can still depend on this arbitrary offset. As a result, two logit representations encoding the same predictive distribution may yield different calibrated probabilities. We define translation-invariant (TI) calibrators as those whose outputs are unchanged under such shifts, characterize which common calibrators satisfy this property, and construct TI counterparts of shift-sensitive calibrators to isolate the effect of removing representation dependence. Second, post-hoc calibration is typically fitted by minimizing a likelihood-based objective, whereas segmentation models are trained with task-specific metrics such as Dice. This mismatch can cause calibration to alter class orderings and degrade the deployed segmentation map. We study decision-preserving calibration under argmax- and order-preservation constraints. Since enforcing these constraints collapses affine softmax calibrators to temperature scaling, we introduce class-conditional affine calibrators that can be made argmax- or order-preserving while retaining greater expressivity, allowing us to quantify the calibration-segmentation trade-off induced by decision preservation. Across natural-image and medical segmentation benchmarks, and under corruption-based covariate shift, matched comparisons show that TI variants generally improve calibration metrics, while decision-preserving variants prevent segmentation degradation and retain strong calibration performance. These results provide practical design principles for well-defined post-hoc calibration pipelines in semantic segmentation.

cs.CV

TwinTrack: Post-hoc Multi-Rater Calibration for Medical Image Segmentation

Pancreatic ductal adenocarcinoma (PDAC) segmentation on contrast-enhanced CT is inherently ambiguous: inter-rater disagreement among experts reflects genuine uncertainty rather than annotation noise. Standard deep learning approaches assume a single ground truth, producing probabilistic outputs that can be poorly calibrated and difficult to interpret under such ambiguity. We present TwinTrack, a framework that addresses this gap through post-hoc calibration of ensemble segmentation probabilities to the empirical mean human response (MHR) -the fraction of expert annotators labeling a voxel as tumor. Calibrated probabilities are thus directly interpretable as the expected proportion of annotators assigning the tumor label, explicitly modeling inter-rater disagreement. The proposed post-hoc calibration procedure is simple and requires only a small multi-rater calibration set. It consistently improves calibration metrics over standard approaches when evaluated on the MICCAI 2025 CURVAS-PDACVI multi-rater benchmark.

cs.LG

Contrastive-to-Self-Supervised: A Two-Stage Framework for Script Similarity Learning

Learning similarity metrics for glyphs and writing systems faces a fundamental challenge: while individual graphemes within invented alphabets can be reliably labeled, the historical relationships between different scripts remain uncertain and contested. We propose a two-stage framework that addresses this epistemological constraint. First, we train an encoder with contrastive loss on labeled invented alphabets, establishing a teacher model with robust discriminative features. Second, we extend to historically attested scripts through teacher-student distillation, where the student learns unsupervised representations guided by the teacher's knowledge but free to discover latent cross-script similarities. The asymmetric setup enables the student to learn deformation-invariant embeddings while inheriting discriminative structure from clean examples. Our approach bridges supervised contrastive learning and unsupervised discovery, enabling both hard boundaries between distinct systems and soft similarities reflecting potential historical influences. Experiments on diverse writing systems demonstrate effective few-shot glyph recognition and meaningful script clustering without requiring ground-truth evolutionary relationships.

cs.CV

Spatiotemporal graph neural process for reconstruction, extrapolation, and classification of cardiac trajectories

We present a probabilistic framework for modeling structured spatiotemporal dynamics from sparse observations, focusing on cardiac motion. Our approach integrates neural ordinary differential equations (NODEs), graph neural networks (GNNs), and neural processes into a unified model that captures uncertainty, temporal continuity, and anatomical structure. We represent dynamic systems as spatiotemporal multiplex graphs and model their latent trajectories using a GNN-parameterized vector field. Given the sparse context observations at node and edge levels, the model infers a distribution over latent initial states and control variables, enabling both interpolation and extrapolation of trajectories. We validate the method on three synthetic dynamical systems (coupled pendulum, Lorenz attractor, and Kuramoto oscillators) and two real-world cardiac imaging datasets - ACDC (N=150) and UK Biobank (N=526) - demonstrating accurate reconstruction, extrapolation, and disease classification capabilities. The model accurately reconstructs trajectories and extrapolates future cardiac cycles from a single observed cycle. It achieves state-of-the-art results on the ACDC classification task (up to 99% accuracy), and detects atrial fibrillation in UK Biobank subjects with competitive performance (up to 67% accuracy). This work introduces a flexible approach for analyzing cardiac motion and offers a foundation for graph-based learning in structured biomedical spatiotemporal time-series data.

cs.LG

PSAT: Pediatric Segmentation Approaches via Adult Augmentations and Transfer Learning

Pediatric medical imaging presents unique challenges due to significant anatomical and developmental differences compared to adults. Direct application of segmentation models trained on adult data often yields suboptimal performance, particularly for small or rapidly evolving structures. To address these challenges, several strategies leveraging the nnU-Net framework have been proposed, differing along four key axes: (i) the fingerprint dataset (adult, pediatric, or a combination thereof) from which the Training Plan -including the network architecture-is derived; (ii) the Learning Set (adult, pediatric, or mixed), (iii) Data Augmentation parameters, and (iv) the Transfer learning method (finetuning versus continual learning). In this work, we introduce PSAT (Pediatric Segmentation Approaches via Adult Augmentations and Transfer learning), a systematic study that investigates the impact of these axes on segmentation performance. We benchmark the derived strategies on two pediatric CT datasets and compare them with state-of-theart methods, including a commercial radiotherapy solution. PSAT highlights key pitfalls and provides actionable insights for improving pediatric segmentation. Our experiments reveal that a training plan based on an adult fingerprint dataset is misaligned with pediatric anatomy-resulting in significant performance degradation, especially when segmenting fine structures-and that continual learning strategies mitigate institutional shifts, thus enhancing generalization across diverse pediatric datasets. The code is available at https://github.com/ICANS-Strasbourg/PSAT.

eess.IV

Surface guided analysis of breast changes during post-operative radiotherapy by using a functional map framework

The treatment of breast cancer using radiotherapy involves uncertainties regarding breast positioning. As the studies progress, more is known about the expected breast positioning errors, which are taken into account in the Planning Target Volume (PTV) in the form of the margin around the clinical target volume. However, little is known about the non-rigid deformations of the breast in the course of radiotherapy, which is a non-negligible factor to the treatment. Purpose: Taking into account such inter-fractional breast deformations would help develop a promising future direction, such as patient-specific adjustable irradiation plannings. Methods: In this study, we develop a geometric approach to analyze inter-fractional breast deformation throughout the radiotherapy treatment. Our data consists of 3D surface scans of patients acquired during radiotherapy sessions using a handheld scanner. We adapt functional map framework to compute inter-and intra-patient non-rigid correspondences, which are then used to analyze intra-patient changes and inter-patient variability. Results: The qualitative shape collection analysis highlight deformations in the contralateral breast and armpit areas, along with positioning shifts on the head or abdominal regions. We also perform extrinsic analysis, where we align surface acquisitions of the treated breast with the CT-derived skin surface to assess displacements and volume changes in the treated area. On average, displacements within the treated breast exhibit amplitudes of 1-2 mm across sessions, with higher values observed at the time of the 25 th irradiation session. Volume changes, inferred from surface variations, reached up to 10%, with values ranging between 2% and 5% over the course of treatment. Conclusions: We propose a comprehensive workflow for analyzing and modeling breast deformations during radiotherapy using surface acquisitions, incorporating a novel inter-collection shape matching approach to model shape variability within a i shared space across multiple patient shape collections. We validate our method using 3D surface data acquired from patients during External Beam Radiotherapy (EBRT) sessions, demonstrating its effectiveness. The clinical trial data used in this paper is registered under the ClinicalTrials.gov ID NCT03801850.

cs.CG

Skin dose in breast radiation therapy: Monte Carlo calculations from deformed vector fields (DVF)-driven CT images

Skin dose in radiotherapy is a key issue for reducing patient side effects, but dose calculations in this high-gradient region remains a challenge. To support radiation therapists and medical physicist in their decisions, a computational tool has been developed to systematically recalculate the skin dose for each treatment session, taking into account changes in breast geometry. This tool is based on Monte Carlo skin dose calculations from deformed vector fields (DVF)-driven CT images, using 3D-scanner data. The application of deformation fields to the initial patient CT, as well as the validation of Monte Carlo skin dose calculations and comparison with TPS algorithm, are presented. The tool is currently being evaluated using data from a clinical study involving 60 patients (MorphoBreast3D).

physics.med-ph

Geometric properties of special orthogonal representations associated to exceptional Lie superalgebras

From an octonion algebra $\mathbb{O}$ over a field $k$ of characteristic not two or three, we show that the fundamental representation ${\rm Im}(\mathbb{O})$ of the derivation algebra ${\rm Der}(\mathbb{O})$ and the spinor representation $\mathbb{O}$ of $\mathfrak{so}({\rm Im}(\mathbb{O}))$ are special orthogonal representations. They have particular geometric properties coming from their similarities with binary cubics and we show that the covariants of these representations and their Mathews identities are related to the Fano plane and the affine space $(\mathbb{Z}_2)^3$. This also permits to give constructions of exceptional Lie superalgebras.

math.RT

Symplectic Dirac operators for Lie algebras and graded Hecke algebras

We define a pair of symplectic Dirac operators $(D^+,D^-)$ in an algebraic setting motivated by the analogy with the algebraic orthogonal Dirac operators in representation theory. We work in the settings of $\mathbb Z/2$-graded quadratic Lie algebras $\mathfrak g=\mathfrak k+\mathfrak p$ and of graded affine Hecke algebras $\mathbb H$.

math.RT

Cubic Dirac operators and the strange Freudenthal-de Vries formula for colour Lie algebras

The aim of this paper is to define cubic Dirac operators for colour Lie algebras. We give a necessary and sufficient condition to construct a colour Lie algebra from an $ε$-orthogonal representation of an $ε$-quadratic colour Lie algebra. This is used to prove a strange Freudenthal-de Vries formula for basic colour Lie algebras as well as a Parthasarathy formula for cubic Dirac operators of colour Lie algebras. We calculate the cohomology induced by this Dirac operator, analogously to the algebraic Vogan conjecture proved by Huang and Pandžić.

math.RT

Involutions of sl(2,k) and non-split, three-dimensional simple Lie algebras

We give a process to construct non-split, three-dimensional simple Lie algebras from involutions of sl(2,k), where k is a field of characteristic not two. Up to equivalence, non-split three-dimensional simple Lie algebras obtained in this way are parametrised by a subgroup of the Brauer group of k and are characterised by the fact that their Killing form represents -2. Over local and global fields we re-express this condition in terms of Hilbert and Legendre Symbols and give examples of three-dimensional simple Lie algebras which can and cannot be obtained by this construction over the field of rationals.

math.RA

Classification of finite-dimensional Lie superalgebras whose even part is a three-dimensional simple Lie algebra over a field of characteristic not two or three

Let $k$ be a field of characteristic not two or three. We classify up to isomorphism all finite-dimensional Lie superalgebras $\mathfrak{g}=\mathfrak{g}_0\oplus \mathfrak{g}_1$ over $k$, where $\mathfrak{g}_0$ is a three-dimensional simple Lie algebra. If $\mathcal{Z}(\mathfrak{g})$ denotes the centre of $\mathfrak{g}$, the result is the following: either $\lbrace \mathfrak{g}_1,\mathfrak{g}_1 \rbrace=\lbrace 0 \rbrace$ or $\mathfrak{g}_1=(\mathfrak{g}_0 \oplus k)\oplus \mathcal{Z}(\mathfrak{g})$ or $\mathfrak{g}\cong \mathfrak{osp}_k(1|2)\oplus \mathcal{Z}(\mathfrak{g})$.

math.RT

The Kostant invariant and special $ε$-orthogonal representations for $ε$-quadratic colour Lie algebras

Let k be a field of characteristic not two or three, let $\mathfrak{g}$ be a finite-dimensional colour Lie algebra and let V be a finite-dimensional representation of $\mathfrak{g}$. In this article we give various ways of constructing a colour Lie algebra $\tilde{\mathfrak{g}}$ whose bracket in some sense extends both the bracket of $\mathfrak{g}$ and the action of $\mathfrak{g}$ on V. Colour Lie algebras, originally introduced by R. Ree ([Ree60]), generalise both Lie algebras and Lie superalgebras, and in those cases our results imply many known results ([Kos99], [Kos01], [CK15], [SS15]). For a class of representations arising in this context we show there are covariants satisfying identities analogous to Mathews identities for binary cubics.

math.RT