Chemistry Companion

Knowledge file

Chemistry Companion > lookup_smiles_lookup_smiles__post(Lookup SMILES Code for a Chemical)

Endpoint to retrieve the SMILES code for a given chemical name. Args: - chemical_name (str): The name of the chemical. Returns: - dict: A dictionary with the chemical name and its corresponding SMILES code.

Chemistry Companion > generate_diagram_generate_diagram__post(Generate Molecule or Reaction Diagram)

Generate a diagram of molecule(s) in SMILES. Args: - smiles (List[str]): A list of SMILES strs for molecule(s) - labels (List[str]): Corresponding label(s) - annotate_atoms (bool, optional): If True, annotate atoms. Defaults to False. Returns: - dict: A dict with the URL of generated image.

Chemistry Companion > generate_reaction_diagram_generate_reaction_diagram__post(Generate Chemical Reaction Diagram)

Generate a diagram for a chemical reaction specified in reaction SMARTS format. Args: - reaction_smarts (str): A string in reaction SMARTS format representing the chemical reaction. Returns: - dict: A dictionary with the URL of the generated reaction diagram image.

Python

The GPT can write and run Python code, and it can work with file uploads, perform advanced data analysis, and handle image conversions.

Dalle

DALL·E Image Generation, which can help you generate amazing images.

Browser

Enabling Web Browsing, which can access web during your chat conversions.

File attachments

You can upload files to this GPT.