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Accelrys discovery studio 3.1 ds
Discovery Studio 3.1 Ds, supplied by Accelrys, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/discovery+studio+3%2E1/discovery+studio+2+5/pm40614347-85-18-22
Average 90 stars, based on 1 article reviews
discovery studio 3.1 ds - by Bioz Stars, 2026-10
90/100 stars

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Article Title: Accumulation of DNA G‐quadruplex in mitochondrial genome hallmarks mesenchymal senescence
Article Snippet: 44 The Discovery Studio 3.1 (Accelrys, Inc. USA) software package was used to prepare the structure including adding hydrogen atoms, removing water molecules, and assigning force field (here the CHARMm force field was adopted).

Article Title: Accumulation of DNA G-quadruplex in mitochondrial genome hallmarks mesenchymal senescence.
Article Snippet: The X- ray crystal structure (PDB entry 2J6M) of the CM22 G4 bound to compound quindoline was used as a reference in the docking studies.44 The Discovery Studio 3.1 (Accelrys, Inc. USA) software package was used to prepare the structure including adding hydrogen atoms, removing water molecules, and assigning force field (here the CHARMm force field was adopted).

Article Title: Design, synthesis, structural characterization, cytotoxicity and computational studies of Usnic acid derivative as potential anti-breast cancer agent against MCF7 and T47D cell lines.
Article Snippet: Development of novel inhibitors is necessary to counteract the rising prevalence of breast cancer (BC) in women in recent years, as evidenced by the side-effect profiles of a few clinically approved inhibitors.. In this study, the usnic acid derivative (UA1) was synthesized due to the effectiveness of usnic acid (UA) against BC cell line.. Furthermore, the structure of synthesized compound was determined using FT-IR, 1H NMR, 13C NMR, HSQC, and HMBC spectroscopic techniques.

Article Title: The inhibition of monoamine oxidase by 2-methylbenzo[d]oxazole derivatives
Article Snippet: The preparation of the protein models and docking simulations were performed with Discovery Studio 3.1 (Accelrys).


Article Title: Construction of Near-Infrared Probes with Remarkable Large Stokes Shift Based on a Novel Purine Platform for the Visualization of mtG4 Upregulation during Mitochondrial Disorder in Somatic Cells and Human Sperms
Article Snippet: The molecular docking studies were performed using GOLD (Genetic Optimization of Ligand Docking) 5.0.3 The X-ray crystal structure (PDB entry 2L7V) of the CM22 G-quadruplex bound to compound quindoline was used as a reference in the docking studies.4 The Discovery Studio 3.1 (Accelrys, Inc. USA) software package was used to prepare the structure including adding hydrogen atoms, removing water molecules, and assigning force field (here the CHARMm force field was adopted).

Binding Assay:

Article Title: Accumulation of DNA G‐quadruplex in mitochondrial genome hallmarks mesenchymal senescence
Article Snippet: 44 The Discovery Studio 3.1 (Accelrys, Inc. USA) software package was used to prepare the structure including adding hydrogen atoms, removing water molecules, and assigning force field (here the CHARMm force field was adopted).

Article Title: Accumulation of DNA G-quadruplex in mitochondrial genome hallmarks mesenchymal senescence.
Article Snippet: The X- ray crystal structure (PDB entry 2J6M) of the CM22 G4 bound to compound quindoline was used as a reference in the docking studies.44 The Discovery Studio 3.1 (Accelrys, Inc. USA) software package was used to prepare the structure including adding hydrogen atoms, removing water molecules, and assigning force field (here the CHARMm force field was adopted).

Article Title: Design, synthesis, structural characterization, cytotoxicity and computational studies of Usnic acid derivative as potential anti-breast cancer agent against MCF7 and T47D cell lines.
Article Snippet: Development of novel inhibitors is necessary to counteract the rising prevalence of breast cancer (BC) in women in recent years, as evidenced by the side-effect profiles of a few clinically approved inhibitors.. In this study, the usnic acid derivative (UA1) was synthesized due to the effectiveness of usnic acid (UA) against BC cell line.. Furthermore, the structure of synthesized compound was determined using FT-IR, 1H NMR, 13C NMR, HSQC, and HMBC spectroscopic techniques.

Article Title: The inhibition of monoamine oxidase by 2-methylbenzo[d]oxazole derivatives
Article Snippet: The preparation of the protein models and docking simulations were performed with Discovery Studio 3.1 (Accelrys).


Article Title: Construction of Near-Infrared Probes with Remarkable Large Stokes Shift Based on a Novel Purine Platform for the Visualization of mtG4 Upregulation during Mitochondrial Disorder in Somatic Cells and Human Sperms
Article Snippet: The molecular docking studies were performed using GOLD (Genetic Optimization of Ligand Docking) 5.0.3 The X-ray crystal structure (PDB entry 2L7V) of the CM22 G-quadruplex bound to compound quindoline was used as a reference in the docking studies.4 The Discovery Studio 3.1 (Accelrys, Inc. USA) software package was used to prepare the structure including adding hydrogen atoms, removing water molecules, and assigning force field (here the CHARMm force field was adopted).



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