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pretrained_checkpoint=None causes inconsistent predictions

Status: Open.

#168 In ChEB-AI/python-chebai;

· schnamo opened on May 6, 2026

Broken / unused chebai features

Status: Open.

#160 In ChEB-AI/python-chebai;

· sfluegel05 opened on Mar 5, 2026

Issue with tokenization

Status: Open.

#134 In ChEB-AI/python-chebai;

· schnamo opened on Nov 11, 2025

·  

v1.2

Upgrade Lightning from 2.5.1 → latest

priority: lowIssue with low priorityIssue with low priority

Status: Open.

#124 In ChEB-AI/python-chebai;

· aditya0by0 opened on Sep 5, 2025

Refactor: Generalize dataset base classes & consolidate dynamic splitting logic

enhancementNew feature or requestNew feature or request

on-holdWork on this issue is temporarily pausedWork on this issue is temporarily paused

priority: lowIssue with low priorityIssue with low priority

Status: Open.

Task

#122 In ChEB-AI/python-chebai;

· aditya0by0 opened on Aug 10, 2025

Upload lightning_config.yaml to W&B online run logs for better traceability

documentationImprovements or additions to documentationImprovements or additions to documentation

enhancementNew feature or requestNew feature or request

priority: lowIssue with low priorityIssue with low priority

Status: Open.

#121 In ChEB-AI/python-chebai;

· aditya0by0 opened on Aug 10, 2025

latest pysmiles not compatible with chebai

on-holdWork on this issue is temporarily pausedWork on this issue is temporarily paused

Status: Open.

#98 In ChEB-AI/python-chebai;

· aditya0by0 opened on Jun 16, 2025

latest rdkit version is not compatible with chebai / SMILES canonicalisation needs to be updated

on-holdWork on this issue is temporarily pausedWork on this issue is temporarily paused

priority: lowIssue with low priorityIssue with low priority

Status: Open.

#83 In ChEB-AI/python-chebai;

· sfluegel05 opened on Apr 25, 2025

chebai does not run with the latest python version

Status: Open.

#66 In ChEB-AI/python-chebai;

· sfluegel05 opened on Dec 2, 2024

Crossvalidation needs to be generalised

Status: Open.

#11 In ChEB-AI/python-chebai;

· sfluegel05 opened on Mar 5, 2024