iiinova — where your digital self keeps evolving

Renato D. Cunha @renatodcunha.bsky.social · 08/04/2026

I am very happy to share that I am back at the Federal University of ABC, Brazil, to start my research group, the Computational Multiscale Modelling of Organic and Biomolecules laboratory (CMOBio Lab). Now you can contact me in renato.cunha@ufabc.edu.br #compchem #newpi #researcher

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Renato D. Cunha @renatodcunha.bsky.social · 06/02/2025

I am launching my GitHub website to share with the #compchem community some codes related to the field. You can find some tools in Python, C-Bash, awk, Plots, and shortly my presentations in PDF. github.com/rdiascunha/c...

github.com

GitHub - rdiascunha/cmoblab: Computational Multiscale of Organic and Biomolecules Laboratory

Computational Multiscale of Organic and Biomolecules Laboratory - rdiascunha/cmoblab

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Reposted by Renato D. Cunha

Justin Lemkul @justinlemkulvt.bsky.social · 21/01/2025

We have a new #tutorial posted online, this time for Gaussian-accelerated MD as implemented in NAMD. Article has been submitted to LiveCoMS, a great venue for such efforts. We welcome feedback! Yes, it's alanine dipeptide, but you have to start somewhere :) #compchem github.com/Lemkul-Lab/g...

github.com

GitHub - Lemkul-Lab/gamd_livecoms_tutorial

Contribute to Lemkul-Lab/gamd_livecoms_tutorial development by creating an account on GitHub.

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