A newer version of the Gradio SDK is available:
5.31.0
metadata
title: LChemME - SMILES canonicalization demo
emoji: ⚛️
colorFrom: blue
colorTo: green
sdk: gradio
sdk_version: 5.22.0
app_file: app.py
pinned: false
license: mit
short_description: SMILES canonicalization with various Large Chemical Models
models:
- scbirlab/lchemme-base-zinc22-lteq300
- scbirlab/lchemme-base-dosedo-lteq300
- facebook/bart-base
preload_from_hub:
- scbirlab/lchemme-base-zinc22-lteq300
- scbirlab/lchemme-base-dosedo-lteq300
- facebook/bart-base
tags:
- chemistry
Demonstration of SMILES canonicalization with pre-trained LChemME checkpoints
Interface to demonstrate SMILES canonicalization using Large Chemical Models pre-trained using LChemME.