3D Molecule Generation

3D molecular generation is a method that uses advanced computational techniques to design three-dimensional molecular structures de novo, aiming to efficiently create novel molecules with specific physicochemical properties and biological activities. This technology leverages deep learning and optimization algorithms to predict and construct the spatial conformations of complex molecules, thereby accelerating the innovation process in drug discovery and materials science. Its core objective is to enhance the accuracy and efficiency of molecular design, reduce experimental costs, and shorten the R&D cycle. In the pharmaceutical field, 3D molecular generation can help identify potential therapeutic targets and develop new drugs, improving disease treatment outcomes.