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molecular representation

Papers

Showing 7180 of 168 papers

TitleStatusHype
Can Molecular Evolution Mechanism Enhance Molecular Representation?0
Representation of Molecules via Algebraic Data Types : Advancing Beyond SMILES & SELFIES0
GenMol: A Drug Discovery Generalist with Discrete Diffusion0
SMI-Editor: Edit-based SMILES Language Model with Fragment-level Supervision0
Tokenizing 3D Molecule Structure with Quantized Spherical Coordinates0
BAPULM: Binding Affinity Prediction using Language ModelsCode0
Chemical Language Model Linker: blending text and molecules with modular adaptersCode0
MolMix: A Simple Yet Effective Baseline for Multimodal Molecular Representation LearningCode0
E3STO: Orbital Inspired SE(3)-Equivariant Molecular Representation for Electron Density Prediction0
FARM: Functional Group-Aware Representations for Small Molecules0
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