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Davide Mottin

7 accepted papers

2025

Automatic Annotation Augmentation Boosts Translation between Molecules and Natural Language

NAACL 2025findings

Recent advancements in AI for biological research focus on integrating molecular data with natural language to accelerate drug discovery. However, the scarcity of high-quality annotations limits progress in this area. This paper introduces LA3, a Language-based Automatic Annotation Augmentation fram…

2025

Automatic Auxiliary Task Selection and Adaptive Weighting Boost Molecular Property Prediction

NeurIPS 2025poster

Recent studies in *Machine Learning* (ML) for biological research focus on investigating molecular properties to accelerate drug discovery. However, limited labeled molecular data often hampers the performance of ML models. A common strategy to mitigate data scarcity is leveraging auxiliary learning…

Cited by 0SourceScholar
2024

FUGAL: Feature-fortified Unrestricted Graph Alignment

NeurIPS 2024poster

The necessity to align two graphs, minimizing a structural distance metric, is prevalent in biology, chemistry, recommender systems, and social network analysis. Due to the problem’s NP-hardness, prevailing graph alignment methods follow a modular and mediated approach, solving the problem by restri…

Cited by 1SourcePDFScholar
2023

ActUp: Analyzing and Consolidating tSNE and UMAP

IJCAI 2023poster

TSNE and UMAP are popular dimensionality reduction algorithms due to their speed and interpretable low-dimensional embeddings. Despite their popularity, however, little work has been done to study their full span of differences. We theoretically and experimentally evaluate the space of parameters in…

2020

The Shape of Data: Intrinsic Distance for Data Distributions

ICLR 2020poster

The ability to represent and compare machine learning models is crucial in order to quantify subtle model changes, evaluate generative models, and gather insights on neural network architectures. Existing techniques for comparing data distributions focus on global data properties such as mean and co…

Cited by 63SourceScholar
2020

What if Neural Networks had SVDs?

NeurIPS 2020spotlight

Various Neural Networks employ time-consuming matrix operations like matrix inversion. Many such matrix operations are faster to compute given the Singular Value Decomposition (SVD). Techniques from (Zhang et al., 2018; Mhammedi et al., 2017) allow using the SVD in Neural Networks without computing…