Endogenous intracellular allosteric modulators of GPCRs remain largely unexplored, with limited binding and phenotype data available. This gap arises from the lack of robust computational methods for ...

PolymerCpp provides a number of Python functions that exposes the C++ routines for generating 3D WLCs, including Important Note: The self-avoiding wormlike chain in this program does not produce the ...

MOFGalaxyNet aims to create a social network for Metal-Organic Frameworks (MOFs) and predict their properties using Graph Convolutional Networks (GCN). It fosters collaboration and exploration in the ...

Abstract: Convolutional Neural Networks (CNN) and Graph Neural Networks (GNN) are two widely used architectures in Hyperspectral Image (HSI) Classification. Most CNN models tend to heavily rely on ...