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Protein ML papers

@jashleym6975

Deep Learning for protein design #Proteins #ML #CompBio #BetterThanTianlai

Protein ML papers Reposted

How to accurately predict small S-T bandgaps? #ORCA6 now has a powerful DeltaSCF implemented. It can directly converge the SCF to an excited state. Here is the famous PTZ-DBTO2 (an important material for TADF-OLEDs!), optimized to its S1. 1/3


Protein ML papers Reposted

Template-independent enzymatic synthesis of RNA oligonucleotides go.nature.com/3zBfDZf

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Protein ML papers Reposted

We were invited to write a review article on DNA/genomic language models (gLMs). We took this occasion to gather our thoughts on promising applications, and major considerations for developing and evaluating gLMs. Pls share with your colleagues: Preprint: arxiv.org/abs/2407.11435


Protein ML papers Reposted

SotA results from #RWKV🚀Restore-RWKV: Efficient and Effective Medical Image Restoration with RWKV (it's using RWKV-4🐦 with Re-RWKV & Omni-shift) code: github.com/Yaziwel/Restor… paper: arxiv.org/abs/2407.11087

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Protein ML papers Reposted

What is the largest QM calculation you ever run? We @faccts_orca did Insulin (3I40) + 2k H2O (image below) with #ORCA6 on a single node (AMD EPYC 7502P, 1 TB RAM). !PBE cc-pVDZ full calculation, no tricks. Won't spoil further. More on the ORCA6 release day (25/07)! #compchem


Protein ML papers Reposted

First text2protein AI model, compressing billions of years of life. 800+ novel, functional and foldable proteins are discovered by researchers. Whitepaper and repo bit.ly/310paper


Protein ML papers Reposted

Data often exhibit non-Euclidean structure: From the curvature of space-time🌐, to topologically complex interactions between neurons🍩, to algebraic transformations describing symmetries in physical systems💎. How can ML/AI best process this data? Check out our new review!

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Protein ML papers Reposted

🌟 New review from the lab! Discover the geometric, topological and algebraic signatures of machine learning and deep learning models. By @naturecomputes @johmathe @mathildepapillo D. Buracas @hansenlillemark @cashewmake2 @AbbyBertics X. Pennec & @ninamiolane !

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In the 20th century, non-Euclidean geometry transformed how we model the world with pen and paper. In this century, it’s revolutionizing how we model the world with machines. Our review on the topic is out arxiv.org/pdf/2407.09468, led w the brilliant @naturecomputes @johmathe

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