Abstract: Underwater docking facilitates autonomous underwater vehicles (AUVs) in energy replenishment and data transmission, extending their operational range. This study focuses on a dual-AUV system ...
Abstract: Recent trends in the HPC field have introduced new CPU architectures with improved vectorization capabilities that require optimization to achieve peak performance and thus pose challenges ...
smile2dock converts SMILES strings (single molecules or libraries) into 3D structures and common molecular file formats (PDB, PDBQT, MOL2, SDF). It also computes several molecular descriptors with ...
Identification of small molecule inhibitors targeting FGFR through molecular docking-based screening
FGFRs genetic alterations such as mutations, amplifications, and chromosomal translocations are prevalent in cancers, leading to the initiation and progression of tumors by enhancing FGFR signaling.
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