Sitelet https://github.com/topics/reaction-modeling

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reaction-modeling

Here are 4 public repositories matching this topic...

TieuLongPhan / SynKit

Toolkit for synthesis planning

rule-based-modeling graph-transformation reaction-informatics reaction-modeling

Updated Oct 2, 2026
Python

TieuLongPhan / SynUtils

Utils for synthesis planning

visualization synthesis reaction-informatics reaction-modeling

Updated Mar 21, 2025
Python

SII-ljh / ReactBC

Bond-change-aware transition-state structure prediction built on React-OT.

pytorch computational-chemistry geometric-deep-learning transition-state reaction-modeling

Updated Aug 3, 2026
Python

saoxxxv / WFIdataprocess

Tools for mechanism-oriented kinetic analysis of chemical reactions.

reaction-modeling physical-organic-chemistry

Updated Dec 20, 2025
Python

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