Molecule Conformers

Molecule Conformers

Predicts optimal molecular conformations from SMILES

Verified
10 conversations
Tools
Molecule Conformers is a tool designed to predict optimal molecular conformations from SMILES notations. This powerful tool can assist in analyzing and discussing the stability of various molecular structures, making it an essential resource for researchers, chemists, and professionals working in the field of molecular science and pharmaceuticals.

How to use

Welcome to Molecule Conformers. To use this tool, follow the steps below:
  1. Provide a SMILES notation for analysis.
  2. Discuss the stability of the specified molecule.
  3. Utilize the tool to predict the conformation for a given SMILES.
  4. Explore the maximum number of atoms (6) with support for specific elements (O, N, C, H) for analysis.

Features

  1. Predicts optimal molecular conformations from SMILES notations
  2. Supports analysis of molecular stability
  3. Provides insights into the stability of specified molecules
  4. Supports prediction of molecule conformation based on input SMILES
  5. Maximizes the analysis within a specified criteria of atoms and supported elements

Updates

2024/01/11

Language

English (English)

Welcome message

Welcome to Molecule Conformers. Please provide a SMILES notation for analysis.

Prompt starters

  • Predict the conformation for a SMILES:
  • The max number of atoms is 6. [Only suport (O,N,C,H) eles]
  • Discuss the stability of the following molecule:
  • You can try "predict CC=CN"

Tools

  • python
  • dalle
  • browser
  • plugins_prototype

Tags

public
reportable
uses_function_calls