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20132026
most citedModeling polypharmacy side effects with graph convolutional networks

1.5k citations · 6.9k across the 102 of their papers we have counts for

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cs.LG2026

When Do Biological Reasoning Models Use Their Biological Inputs?

Ada Fang, Nikitha Thoduguli, Lukas Fesser +3

Biological reasoning models use post-training to connect LLMs to biological foundation model representations and biological text. Their benchmark accuracy is taken as evidence that…

cs.LG2026

How Post-Training Shapes Biological Reasoning Models

Lukas Fesser, Hanlin Zhang, Michelle M. Li +5

Scientific reasoning models for biology combine language models with foundation models trained on multimodal biological data, including DNA, RNA, and proteins. These models are bui…

cs.LG2026

When Sensors Fail: Temporal Sequence Models for Robust PPO under Sensor Drift

Kevin Vogt-Lowell, Theodoros Tsiligkaridis, Rodney Lafuente-Mercado +4

Real-world reinforcement learning systems must operate under distributional drift in their observation streams, yet most policy architectures implicitly assume fully observed and n…

cs.LG2026

Distribution-Conditioned Transport

Nic Fishman, Gokul Gowri, Paolo L. B. Fischer +3

Learning a transport model that maps a source distribution to a target distribution is a canonical problem in machine learning, but scientific applications increasingly require mod…

cs.LG2026

Adaptive Time Series Reasoning via Segment Selection

Shvat Messica, Jiawen Zhang, Kevin Li +2

Time series reasoning tasks often start with a natural language question and require targeted analysis of a time series. Evidence may span the full series or appear in a few short…

cs.LG2026

Beyond Affinity: A Benchmark of 1D, 2D, and 3D Methods Reveals Critical Trade-offs in Structure-Based Drug Design

Kangyu Zheng, Kai Zhang, Jiale Tan +7

Currently, the field of structure-based drug design is dominated by three main types of algorithms: search-based algorithms, deep generative models, and reinforcement learning. Whi…