Announcing Natural Language Computation Chemistry CLI (nlcc)! @glenhocky and I have packaged some common computational chemistry tasks into a new command line tool that uses natural language instead of code via @OpenAI CODEX github.com/whitead/nlcc
8:18 PM · Sep 10, 2021
We're trying to collect useful prompts for working in different contexts, like quantum calculations or plotting. We welcome PRs/Issues. A codex API key is required to use. If you find this interesting, read our recent perspective on it!
1/6 For the last few months @glenhocky and I have been asking what large language models (LLM) can do for chemistry. In our new preprint, we show LLMs know a bit of chemistry and can do a lot: like compute the dissociation curve of H2. arxiv.org/abs/2108.13360Show this thread