materials studio v4 4 software package (Accelrys)
86
Structured Review
Accelrys
materials studio v4 4 software package
Materials Studio V4 4 Software Package, supplied by Accelrys, 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/materials+studio+software/materials+software+studio/pm42271161-141-7-12
Average 86 stars, based on 1 article reviews
Materials Studio V4 4 Software Package, supplied by Accelrys, 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/materials+studio+software/materials+software+studio/pm42271161-141-7-12
Average 86 stars, based on 1 article reviews
materials studio v4 4 software package - by Bioz Stars,
2026-10
86/100 stars
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Software:Article Title: Gecko‐Inspired Adhesive for Robotic Grippers with Excellent Ultra‐Low‐Temperature Adhesion Performance Article Snippet: .. All MD simulations in this study were carried out using Article Title: Development of long-acting riluzole transdermal patch against amyotrophic lateral sclerosis: Mechanistic insights into polyglyceryl-3 dioleate-enhanced drug release and skin permeation Article Snippet: .. Molecular docking simulations were conducted with Article Title: Supramolecular calix[6]arene-COF with pocket-like cavities for host-guest recognition-based SERS detection of tryptamine and seafood freshness monitoring. Article Snippet: Monitoring seafood freshness is critical for ensuring nutritional value and food quality, but targeted analysis in complex matrices remains challenging.. Herein, a thiol-functionalized calix[6]arene covalent organic framework grafted with AuNPs, denoted as CX6-SCOF-AuNPs, was strategically designed for rapid, sensitive and selective detection of tryptamine in seafood by surface-enhanced Raman spectroscopy (SERS).. CX6-SCOF-AuNPs featured extensive pocket-like hydrophobic cavities integrated within an ordered porous structure, enabling specific capture of tryptamine with exceptional enrichment capacity (203.4 mg/g) and rapid adsorption kinetics (within 2 min). Article Title: Tailoring the Electronic Structure of Nickel With Ruthenium Nanocluster Arrays by Phosphorus Modification for Ampere‐Level Hydrogen Production Article Snippet: .. DFT calculations were performed using the CASTEP module of the Article Title: Deep eutectic solvent-assisted extraction of cinnamaldehyde-rich cinnamon (Cinnamomum cassia) essential oil: enabled by molecular simulation and microwave-ultrasound pretreatment. Article Snippet: Cinnamomum essential oil (CEO), particularly its major component cinnamaldehyde (CA), shows strong antibacterial and antioxidant activities but is inefficiently extracted by conventional hydrodistillation.. Here, a molecular mechanism guided strategy is used to screen deep eutectic solvents (DESs), and choline chloride-glycerol is identified as the optimal one through binding energy and frontier orbital analyses.. Microwave-ultrasound pretreatment combined with DESs is applied, and subsequent by the hydrodistillation. Article Title: Microscopic Adsorption Behaviors of DTAB on Quartz (101) Face and Their Effects on Wettability Article Snippet: .. MD simulations were conducted using Article Title: Multiscale Interface Design of Carboxylated MWCNTs/CIPs-OH Hybrid Magnetorheological Fluids for Enhanced Field-Induced Rheological Properties. Article Snippet: Achieving simultaneous enhancement of fieldinduced rheological performance and sedimentation stability remains a persistent challenge for magnetorheological fluids (MRFs).. Here, we propose a multiscale interfacial engineering strategy that integrates hydroxylated carbonyl iron particles (CIPs− OH) with carboxylated multiwalled carbon nanotubes (MWCNTs) to address this long-standing trade-off.. By introducing abundant hydroxyl groups onto the CIPs’ surface and incorporating mechanically robust carboxylated MWCNTs, a hybrid MRF system was constructed via a combination of mechanical mixing and ultrasonic dispersion. Article Title: Corncob-Derived Binder with Synergistic Dust Control: Fabrication, Multi-Scale Characterization, and Field-Relevant Performance Article Snippet: .. The surface behavior of the dust suppressant on coal including molecular migration and dynamic wetting was investigated via molecular dynamics (MD) simulations using Docking Assay:Article Title: Development of long-acting riluzole transdermal patch against amyotrophic lateral sclerosis: Mechanistic insights into polyglyceryl-3 dioleate-enhanced drug release and skin permeation Article Snippet: .. Molecular docking simulations were conducted with Construct:Article Title: Supramolecular calix[6]arene-COF with pocket-like cavities for host-guest recognition-based SERS detection of tryptamine and seafood freshness monitoring. Article Snippet: Monitoring seafood freshness is critical for ensuring nutritional value and food quality, but targeted analysis in complex matrices remains challenging.. Herein, a thiol-functionalized calix[6]arene covalent organic framework grafted with AuNPs, denoted as CX6-SCOF-AuNPs, was strategically designed for rapid, sensitive and selective detection of tryptamine in seafood by surface-enhanced Raman spectroscopy (SERS).. CX6-SCOF-AuNPs featured extensive pocket-like hydrophobic cavities integrated within an ordered porous structure, enabling specific capture of tryptamine with exceptional enrichment capacity (203.4 mg/g) and rapid adsorption kinetics (within 2 min). Migration:Article Title: Corncob-Derived Binder with Synergistic Dust Control: Fabrication, Multi-Scale Characterization, and Field-Relevant Performance Article Snippet: .. The surface behavior of the dust suppressant on coal including molecular migration and dynamic wetting was investigated via molecular dynamics (MD) simulations using |