Author

Li Qin

2 papers indexed here

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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

Open access Jul 2026

Structure-Based Design of New Nonpeptidic Covalent Mpro Inhibitors against SARS-CoV-2 and Omicron Variants

The structure-based covalent modifications that generate new nonpeptidic covalent Mpro inhibitors are described that may support the deuterated compound as a new lead for developing anti-SARS-CoV-2 drugs and further reveal the feasibility of using chloroacetyl for structure-based covalent drug design.

Honglei Bao, Ling-Chen Sun, Shi-Lin Gong et al. · ACS Bio & Med Chem Au · 0 citations