Thea K. Schulze
@tkschulze.bsky.social
📤 91
📥 147
📝 0
Postdoc, Biomolecular Simulation, MRC Laboratory of Molecular Biology
reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
27 days ago
We (
@sobuelow.bsky.social
&
@kejohansson.bsky.social
) tested AF-CALVADOS using the recently described PeptoneBench SAXS benchmark that contains SAXS data for >400 proteins with different amounts of order and disorder. The results look pretty good 😇 so we are sharing here while updating the preprint📝
add a skeleton here at some point
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reposted by
Thea K. Schulze
Jingyou Rao
2 months ago
🎙️ Next up Dec 2 in VESS! Thea Schulze (Lindorff-Larsen Lab): Predicting mutated protein abundance
@tkschulze.bsky.social
Taylor Mighell (Lehner Lab): Massive mutagenesis to understand GPCRs
@taylor-mighell.bsky.social
🔗 More info at
varianteffect.org/seminar-series
@varianteffect.bsky.social
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
3 months ago
We (
@sobuelow.bsky.social
) developed AF-CALVADOS to integrate AlphaFold and CALVADOS to simulate flexible multidomain proteins at scale See preprint for: — Ensembles of >12000 full-length human proteins — Analysis of IDRs in >1500 TFs 📜
doi.org/10.1101/2025...
💾
github.com/KULL-Centre/...
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
6 months ago
Arriën & Giulio's paper on A coarse-grained model for disordered proteins under crowded conditions (that is the CALVADOS PEG model) is now published in final form:
dx.doi.org/10.1002/pro....
@asrauh.bsky.social
@giuliotesei.bsky.social
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
8 months ago
Led by
@vvouts.bsky.social
in
@rhp-lab.bsky.social
, we measured the degron potency of >200,000 30-residue tiles from >5,000 cytosolic human proteins and trained an ML model for degrons 📜
www.biorxiv.org/content/10.1...
🖥️
github.com/KULL-Centre/...
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reposted by
Thea K. Schulze
Giulio Tesei
9 months ago
Happy to share a walkthrough of the applications of our package for simulations using CALVADOS! Big thanks to
@sobuelow.bsky.social
,
@lindorfflarsen.bsky.social
, and the whole team for making this possible. Thrilled to mark this as my first last-author paper!
add a skeleton here at some point
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
9 months ago
Do you like CALVADOS but are not quite sure how to make it? We’ve got your back!
@sobuelow.bsky.social
&
@giuliotesei.bsky.social
—together with the rest of the team—describe our software for simulations using the CALVADOS models incl. recipes for several applications. 1/5
doi.org/10.48550/arX...
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
9 months ago
Supervised training using data generated by multiplexed assays of variant effects is potentially very powerful, but is made difficult by assay- and protein-specific effects Here
@tkschulze.bsky.social
devised a strategy to take this into account while training models
www.biorxiv.org/content/10.1...
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
over 1 year ago
New preprint w
@tkschulze.bsky.social
who analysed cellular abundance (VAMP-seq) data for ~32,000 variants of six proteins 🧪 We find that much of the variation can be explained and predicted by a burial-dependent substitution matrix Lots more goodies in the paper
doi.org/10.1101/2024...
add a skeleton here at some point
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reposted by
Thea K. Schulze
Kresten Lindorff-Larsen
almost 2 years ago
Big congratulations to PhD student Thea K Schulze from our PRISM centre on being awarded the elite research travel grant by the Minister for Higher Education and Science, Christina Egelund, to support a stay at Berkeley to study protein variant effects
www1.bio.ku.dk/nyheder/2024...
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