Hugging Face Trending Papers

Geometric organization of olfactory descriptor data in the Poincaré disk

arXiv Machine Learning
Aug 27

A General-Purpose Molecular Foundation Model Transfers Across Diverse Olfactory Tasks

The study fine‑tunes the Uni‑Mol2 molecular foundation model on the GS‑LF benchmark for multi‑label odor descriptor prediction. The resulting model matches or surpasses state‑of‑the‑art baselines on the primary benchmark and successfully transfers to four downstream olfactory tasks—including cross‑dataset prediction, odorless vs. odorous classification, enantiomer evaluation, and odor mixture discriminability—without further deep‑learning training. The enantiomer analysis demonstrates that 3D molecular representations can distinguish mirror‑image molecules, a capability lacking in 2D graph models, though predicting stereochemistry’s perceptual effects remains unresolved.

By Yikun Han, Yi Wang, Neil Mankodi, Stephen Yang, Ambuj Tewari
arXiv Machine Learning
Sep 14

Decoding Mixture Perception through Computational Modeling of Component Interactions

The paper introduces a bio‑inspired deep learning framework that models olfactory perception of complex chemical mixtures. It constructs neural response curves for molecule‑receptor interactions, fuses attention‑weighted multi‑receptor and concentration‑dependent multi‑molecule data, and transfers knowledge from molecular associations to improve mixture recognition. The model achieves 92.2% accuracy and offers a generalizable computational pathway from chemical blending to perceptual formation.

By Fei Wang, Xiaoya Xie, Junfei Liu, Huihao Wang, Yixiao Wang, Yintao Wang, Yi Li, Hao Dong, Xing Chen
arXiv Machine Learning
Sep 14

What an odour descriptor corpus can and cannot measure: valence, attenuation, and the ceiling of the public record

The study evaluates the reliability of shared odor descriptor words across four public corpora from Pyrfume, finding substantial disagreement (I² = 80 %) and limited agreement on descriptor application (median tetrachoric = 0.795, κ = 0.413). Only a fraction of the achievable variance in odor perception is captured by current models and descriptor sets, with valence emerging as the primary missing component. Even with extensive model capacity and merged corpora, the gap remains, indicating that valence must be measured directly to improve machine olfaction.

By Stylianos Kampakis, Fabio Rovai
arXiv AI
Jul 29

Beyond Predictive Accuracy: A Reliability-Aware Audit of Molecular Representations for Human Olfaction

arXiv:2607. 24848v1 Announce Type: cross Abstract: Pretrained molecular encoders are commonly evaluated through downstream prediction, but predictive accuracy alone does not establish that a learned representation captures reproducible scientific structure, adds information beyond strong conventional baselines, or transfers out of distribution.

By Kai Lun Huang (California State University, Fullerton), Wei Chieh Sun (University of Washington)
arXiv AI
Oct 15

AromaGen: Interactive Generation of Rich Olfactory Experiences with Multimodal Language Models

AromaGen is a 12‑channel wearable system that translates free‑form natural‑language descriptions into olfactory experiences by selecting from 12 base odorants that span a semantically derived olfactory space. The system supports iterative refinement via natural‑language feedback. In a study with 60 participants and 50 benchmark smells, users could identify AromaGen‑generated scents above chance, and AI‑generated compositions performed comparably to human experts, with feedback improving perceived similarity.

By Awu Chen, Silang Wang, Yunge Wen, Jianing Yu, Zinab Eisa, Ana Julia Santos Lopes, Jas Brooks, Hiroshi Ishii, Paul Pu Liang
arXiv Machine Learning
Jul 17

cGAP: Generalized Association Plots with HOMALS-Guided Heatmaps for Visualization of High-Dimensional Categorical Data

arXiv:2607. 15018v1 Announce Type: cross Abstract: High-dimensional categorical data arise in genetics, biomedicine, and the social sciences, yet visualization tools for such data remain far less developed than those for continuous variables.

By Chun-houh Chen, Shun-Chuan Chang, Chiun-How Kao, Yi-Ju Lee, Shang-Ying Shiu, Yin-Jing Tien, ShengLi Tzeng, Han-Ming Wu
arXiv Computer Vision
Aug 27

Do Vision-Language Models Agree on the Affective Qualities of Shape? A Cross-Model Audit for Generative Design Interfaces

The study audits six vision‑language models (VLMs) to assess whether they consistently encode affective qualities of 3D shapes, using Kansei adjective pairs as affective axes. Across ten ShapeNet categories, models show moderate agreement (mean rank correlation 0.36) that is lower than geometric controls but higher than unrelated adjective pairs, with convergence varying widely by category and axis. The authors demonstrate how this audit informs a UI prototype that selectively exposes Kansei descriptors for generative design interfaces.

By Luca Bux, Thiago Rios, Ingo Scholtes, Stefan Menzel