Luis J Walter
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Explore the profile of Luis J Walter including associated specialties, affiliations and a list of published articles.
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Recent Articles
1.
Bereau T, Walter L, Rudzinski J
J Chem Inf Model
. 2024 Dec;
64(24):9413-9423.
PMID: 39621071
Despite their wide use and far-reaching implications, molecular dynamics (MD) simulations suffer from a lack of both traceability and reproducibility. We introduce Martignac: computational workflows for the coarse-grained (CG) Martini...
2.
Walter L, Quoika P, Zacharias M
J Chem Inf Model
. 2024 Apr;
64(8):3465-3476.
PMID: 38602938
Many biological functions are mediated by large complexes formed by multiple proteins and other cellular macromolecules. Recent progress in experimental structure determination, as well as in integrative modeling and protein...