v0.1.0-preprint of DESP (Double-Ended Synthesis Planning) contains code and documentation to process raw reaction data, extract training examples for specialized models, and perform searches with DESP on benchmarks or user-defined target-s.m. pairs.
v0.1.0-preprint of DESP (Double-Ended Synthesis Planning) contains code and documentation to process raw reaction data, extract training examples for specialized models, and perform searches with DESP on benchmarks or user-defined target-s.m. pairs.