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Molecular Dynamics Inc gromacs 2022 program
Gromacs 2022 Program, supplied by Molecular Dynamics Inc, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/gromacs+2022+program/2022+gromacs/pmc12993418-103-8-0
Average 86 stars, based on 1 article reviews
gromacs 2022 program - by Bioz Stars, 2026-10
86/100 stars

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Article Title: Exploring the association between air pollutants and non-small cell lung cancer using network toxicology and machine learning
Article Snippet: Molecular dynamics simulation (MD) was performed using the GROMACS 2022 program.

Article Title: Network Pharmacology and Molecular Dynamics Identified Potential Androgen Receptor-Targeted Metabolites in Crocus alatavicus .
Article Snippet: Molecular dynamics (MD) simulation was carried out using the Gromacs 2022 program.

Article Title: Vaccarin Ameliorates Renal Fibrosis by Inhibiting Ferroptosis via Nrf2/SLC7A11/GPX4 Signaling Pathway
Article Snippet: Molecular dynamics simulations with the GROMACS 2022 program provide insight into the stability of protein-ligand interactions.

Article Title: A fast and efficient virtual screening and identification strategy for helix peptide binders based on finDr webserver: A case study of bovine serum albumin (BSA).
Article Snippet: Peptides offer unique advantages, including strong specificity, rapid action, and low side effects, making them a prominent focus in the development of new drugs and functional materials.. However, the rapid and efficient screening and identification of high-affinity peptides for specific targets remains a significant challenge.. In this study, we successfully screened 12-helix candidate peptides using bovine serum albumin (BSA) as the target protein, employing the computer-aided peptide virtual screening webserver finDr.

Article Title: Computational evaluation of Withania somnifera phytocompounds targeting SARS-CoV-2 ORF9b Protein: Insights from molecular docking, ADMET and MD simulations
Article Snippet: Molecular dynamics (MD) simulations were performed using the GROMACS 2022 program, and the simulation conditions carried out were set to constant temperature, pressure, and periodic boundary conditions.

Article Title: Multi-strategy computational screening and single-point saturation mutation optimize catalytic efficiency and thermal stability of glucose oxidase.
Article Snippet: Molecular dynamics (MD) simulations were conducted using the Gromacs 2022 program.

Article Title: The Combination of Gastrodin and Gallic Acid Synergistically Attenuates AngII-Induced Apoptosis and Inflammation via Regulation of Sphingolipid Metabolism
Article Snippet: Molecular dynamics simulations (MD) were conducted using the GROMACS 2022 program with constant temperature, pressure, and periodic boundary conditions.

Article Title: Exploring the therapeutic mechanism of curcumin in prostate cancer using network pharmacology and molecular docking
Article Snippet: Molecular dynamics (MD) simulations were performed using the Gromacs 2022 program, and the simulation conditions were set to constant temperature, pressure, and periodic boundary conditions.



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