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Unveiling the conformational landscape of tizanidine and its effects on selective nucleation: Enabling controlled manipulation of polymorphs and solvates

Separation and purification technology, 2025-02, Vol.354, p.128827, Article 128827

2025

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The myriad roles of RNA structure in the flavivirus life cycle

RNA biology, 2024-12, Vol.21 (1), p.14-30

2024

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On the relevance of query definition in the performance of 3D ligand-based virtual screening

Journal of computer-aided molecular design, 2024-12, Vol.38 (1), p.18-18, Article 18

2024

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Mutational analysis in Corynebacterium stationis MFS transporters for improving nucleotide bioproduction

Applied microbiology and biotechnology, 2024-12, Vol.108 (1), p.251-251, Article 251

2024

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Constructing soybean protein isolate /bacterial cellulose co-assemblies by pH shifting treatment: Molecular conformation and physicochemical properties

Food chemistry, 2024-12, Vol.460 (Pt 2), p.140628, Article 140628

2024

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User-centric design of a 3D search interface for protein-ligand complexes

Journal of computer-aided molecular design, 2024-12, Vol.38 (1), p.23, Article 23

2024

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Combinatorial targeting of telomerase and DNA-PK induces synergistic apoptotic effects against Pre-B acute lymphoblastic leukemia cells

Molecular biology reports, 2024-12, Vol.51 (1), p.163-163, Article 163

2024

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Xanthan: enzymatic degradation and novel perspectives of applications

Applied microbiology and biotechnology, 2024-12, Vol.108 (1), p.227-227, Article 227

2024

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Foot-and-mouth disease virus dynamics in border areas of Pakistan with Afghanistan

Molecular biology reports, 2024-12, Vol.51 (1), p.370-370, Article 370

2024

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Transitions in chromatin conformation shaped by fatty acids and the circadian clock underlie hepatic transcriptional reorganization in obese mice

Cellular and molecular life sciences : CMLS, 2024-12, Vol.81 (1), p.309, Article 309

2024

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Unveiling the crucial role of betaine: modulation of GABA homeostasis via SLC6A1 transporter (GAT1)

Cellular and molecular life sciences : CMLS, 2024-12, Vol.81 (1), p.269, Article 269

2024

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Fe-S cluster biosynthesis and maturation: Mass spectrometry-based methods advancing the field

Biochimica et biophysica acta. Molecular cell research, 2024-10, Vol.1871 (7), p.119784, Article 119784

2024

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Effects of an external static EF on the conformational transition of 5-HT1A receptor: A molecular dynamics simulation study

Biophysical chemistry, 2024-09, Vol.312, p.107283, Article 107283

2024

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Conformational changes induced by selected flavor compounds from spices regulate the binding ability of myofibrillar proteins to aldehyde compounds

Food chemistry, 2024-09, Vol.451, p.139455-139455, Article 139455

2024

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The crosslinking sites and molecular conformation of gelatin hydrogel modified by transglutaminase

Food hydrocolloids, 2024-09, Vol.154, p.110132, Article 110132

2024

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The solvation thermodynamics of rose acetate in four mixed solvents: Molecular dynamics simulation, molecular conformation analysis, machine learning and solubility prediction

Journal of molecular liquids, 2024-09, Vol.409, p.125449, Article 125449

2024

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The impact of ultrasonic‐assisted extraction on the in vitro hypoglycemic activity of peach gum polysaccharide in relation to its conformational conversion

Journal of the science of food and agriculture, 2024-08, Vol.104 (11), p.6947-6956

2024

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Conformational analysis and spectroscopic properties of antichagasic nifurtimox

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2024-08, Vol.316, p.124346, Article 124346

2024

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Relationships between conformational and vibrational features of tryptophan characteristic Raman markers

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2024-08, Vol.316, p.124377

2024

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Structural characterization and human gut microbiota fermentation in vitro of a polysaccharide from Fucus vesiculosus

International journal of biological macromolecules, 2024-08, Vol.275 (Pt 1), p.133369, Article 133369

2024

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Molecular basis for differential recognition of an allosteric inhibitor by receptor tyrosine kinases

Proteins, structure, function, and bioinformatics, 2024-08, Vol.92 (8), p.905-922

2024

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Screening of Potential Inhibitors Targeting the Main Protease Structure of SARS-CoV-2 via Molecular Docking, and Approach with Molecular Dynamics, RMSD, RMSF, H-Bond, SASA and MMGBSA

Molecular biotechnology, 2024-08, Vol.66 (8), p.1919-1933

2024

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Differential effects of ganglioside lipids on the conformation and aggregation of islet amyloid polypeptide

Protein science, 2024-08, Vol.33 (8), p.e5119-n/a

2024

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Unraveling the binding behavior of the antifouling biocide 4,5-dichloro-2-n-octyl-4-isothiazolin-3-one with human serum albumin: Multi-spectroscopic, atomic force microscope, computational simulation, and esterase activity

International journal of biological macromolecules, 2024-08, Vol.274 (Pt 1), p.133266, Article 133266

2024

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Atomistic Characterization of Healthy and Damaged Hair Surfaces: A Molecular Dynamics Simulation Study of Fatty Acids on Protein Layer

Chembiochem : a European journal of chemical biology, 2024-08, Vol.25 (15), p.e202400128-n/a

2024

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