Original name record: Iambic Therapeutics, Inc.; CALIFORNIA INSTITUTE OF TECHNOLOGY; NVIDIA CORPORATION

In some aspects, the present disclosure provides a method for generating a geometrical structure of a binding complex formed between a protein and a ligand. In some embodiments, the method comprises sampling an initial geometrical structure of the binding complex from a geometry prior. In some embodiments, the method comprises denoising, using a machine-learned stochastic differential equation (SDE), the initial geometrical structure to generate the geometrical structure of the binding complex.