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Sarah Maier

As seen in: Wiley Online Library, ACS Publications, ConsumerAffairs, ChemistryViews, The Journal of Allergy & Clinical Immunology, KFXK-TV (Tyler, TX), Security Insider, IT-BUSINESS, DataCenter Insider, Storage Insider and

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Sarah Maier’s Journalist Portfolio

Howard Marans MD: Where Is The Best Doctor For ACL Treatment In Huntington Beach?

Howard Marans MD: Where Is The Best Doctor For ACL Treatment In Huntington Beach?

Supporting and maintaining the knee joint is the function of numerous tendons and ligaments. The anterior cru…

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Howard Marans MD: What To Look For To Tell If You Fractured Your Wrist

Howard Marans MD: What To Look For To Tell If You Fractured Your Wrist

Wrist fractures are a serious and painful condition that usually occurs as a result of trauma, such as breaki…

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Articles

Predictors of Survival in Friedreich's Ataxia: A Prospective Cohort Study

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By Elisabetta Indelicato, Kathrin Reetz, Sarah Maier, Wolfgang Nachbauer
| Wiley Online Library Verified
Friedreich's ataxia (FA) (OMIM #229300) is the most frequent inherited ataxia and a devastating multisystemic disease affecting up to 1:20,000 individuals in the Caucasian population.1 In around 96% of patients the disease is triggered by biallelic GAA-trinucleotide expansions in the first intron of the frataxin gene.2 Few patients are compound heterozygous for one GAA expansion and a canonical variant (missense, deletion).2 Intronic GAA expansions repress the transcription of frataxin gene,...
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Leveraging DFT and Molecular Fragmentation for Chemically Accurate pKa Prediction Using Machine Learning

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By Sarah Maier, Krishnan Raghavachari
| dx.doi.org
Download Hi-Res ImageDownload to MS-PowerPointCite This:J. Chem. Inf. Model. 2024, XXXX, XXX Terms & Conditions Most electronic Supporting Information files are available without a subscription to ACS Web Editions. Such files may be downloaded by article for research use (if there is a public use license linked to the relevant article, that license may permit other uses).
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Toward Post-Hartree-Fock Accuracy for Protein-Ligand Affinities Using the Molecules-in-Molecules Fragmentation-Based Method

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By Ankur Gupta Verified, Sarah Maier, Bishnu Bahadur Thapa, Krishnan Raghavachari
| dx.doi.org
The complexity and size of large molecular systems, such as protein–ligand complexes, pose computational challenges for accurate post-Hartree–Fock calculations. This study delivers a thorough benchmarking of the Molecules-in-Molecules (MIM) method, presenting a clear and accessible strategy for layer/theory selections in post-Hartree–Fock computations on substantial molecular systems, notably protein–ligand complexes.
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