Open access
Sep 2026
Task-adaptive multimodal molecular representations for structure-sensitive property prediction
CAMF (Chirality- and Activity-cliff-aware Multimodal Framework), a task-adaptive framework that models SSPs through selective integration of complementary molecular evidence, reveals that modality relevance is strongly task-dependent, with descriptors and 3D geometry becoming especially important in non-smooth property...
Shaolong Lin, Si-Long Zhai, Shi-Hang Wang et al.
· Chemical Science · 0 citations