Yoshitaka Moriwaki
@agsmith.bsky.social
とある文京区のJKラボォです。タンパク質の立体構造とバイオインフォマティクスに興味があります。I'm interested in protein bioinformatics. ORCID: 0000-0003-0448-9790
The Terada and Leow groups have developed ColabReaction, a cloud-based tool that accelerates transition-state searches using the machine learning potential UMA. This work was featured as a journal cover.
available at: colabreaction.net
pubs.acs.org/doi/10.1021/...
available at: colabreaction.net
pubs.acs.org/doi/10.1021/...
November 11, 2025 at 11:00 AM
The Terada and Leow groups have developed ColabReaction, a cloud-based tool that accelerates transition-state searches using the machine learning potential UMA. This work was featured as a journal cover.
available at: colabreaction.net
pubs.acs.org/doi/10.1021/...
available at: colabreaction.net
pubs.acs.org/doi/10.1021/...
Our latest work has been published! Our additional implementation for Boltz-1 largely improves the stereochemical accuracy of predicted ligand molecule without retraining the model.
We also developed a notebook on Google Colaboratory, colab.research.google.com/github/cddla... .
We also developed a notebook on Google Colaboratory, colab.research.google.com/github/cddla... .
March 29, 2025 at 11:26 AM
Our latest work has been published! Our additional implementation for Boltz-1 largely improves the stereochemical accuracy of predicted ligand molecule without retraining the model.
We also developed a notebook on Google Colaboratory, colab.research.google.com/github/cddla... .
We also developed a notebook on Google Colaboratory, colab.research.google.com/github/cddla... .
