Reproduce “PubChemQC B3LYP/6-31G*//PM6 dataset: the Electronic Structures of 86 Million Molecules using B3LYP/6-31G* calculations” on OpenResearch
Turn your favorite coding agents into research agents that review literature, develop hypotheses, and run experiments.
Universal app for Apple silicon and Intel. Requires macOS 11 or later.
About this paper
Maho Nakata, Toshiyuki Maeda
Tip: change arxiv.org to autoarxiv.org in any arXiv abstract link to open the paper here.