/tools/SurfGen

SurfGen

OdinZhang/SurfGen

71 stars13 forksPythonAdded February 5, 2026
summary

SurfGen is a tool designed for generating 3D molecular structures by learning from topological surfaces and geometric features. It utilizes a dataset for training and provides functionalities for generating molecules, particularly targeting pharmaceutical applications.

description

SurfGen: Learning on Topological Surface and Geometric Structure for 3D Molecular Generation

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