In silico design - Open Access .click

Results 201 to 210 of about 169,844 (308)

Advancing Efficient Error Reduction in DNA Data Storage Systems with Deep Learning‐Based Denoising Models

Advanced Intelligent Discovery, EarlyView.
Deep learning‐based denoising models are applied to DNA data storage systems to enhance error reduction and data fidelity. By integrating DnCNN with DNA sequence encoding methods, the study demonstrates significant improvements in image quality and correction of substitution errors, revealing a promising path toward robust and efficient DNA‐based ...
Seongjun Seo +5 more
wiley +1 more source

In Silico Design and Characterization of the Essential Outer-Membrane Lipoprotein LolB-Derived Multi-Epitope Vaccine Candidate Against <i>Pseudomonas aeruginosa</i>. [PDF]

Methods Protoc
Yakobi SH, Nwodo UU.
europepmc +1 more source

Toward Predictable Nanomedicine: Current Forecasting Frameworks for Nanoparticle–Biology Interactions

Advanced Intelligent Discovery, EarlyView.
Predictive models successfully screen nanoparticles for toxicity and cellular uptake. Yet, complex biological dynamics and sparse, nonstandardized data limit their accuracy. The field urgently needs integrated artificial intelligence/machine learning, systems biology, and open‐access data protocols to bridge the gap between materials science and safe ...
Mariya L. Ivanova +4 more
wiley +1 more source

Harnessing in Silico Design for Electrochemical Aptasensor Optimization: Detection of Okadaic Acid (OA). [PDF]

Biosensors (Basel)
Vit M +4 more
europepmc +1 more source

Interpretability and Representability of Commutative Algebra, Algebraic Topology, and Topological Spectral Theory for Real‐World Data

Advanced Intelligent Discovery, EarlyView.
This article investigates how persistent homology, persistent Laplacians, and persistent commutative algebra reveal complementary geometric, topological, and algebraic invariants or signatures of real‐world data. By analyzing shapes, synthetic complexes, fullerenes, and biomolecules, the article shows how these mathematical frameworks enhance ...
Yiming Ren, Guo‐Wei Wei
wiley +1 more source

In Silico Design of Antimicrobial Dental Resins Targeting Streptococcus mutans Adhesin P1. [PDF]

Microbiologyopen
Saini RS +8 more
europepmc +1 more source

Evaluating Three Foundation Potentials for Predicting Selected Properties of the Co–Ni–Ru Alloy System

Advanced Intelligent Discovery, EarlyView.
Distributions of intrinsic stacking fault energies (ISFE) among different slip planes in the face‐centered cubic Co2Ni2Ru alloy, predicted by three foundation potentials (DPA, Orb, and SevenNet) and density functional theory (DFT) calculations. This study evaluates the efficacy of three foundation potentials (FPs)—SevenNet, DPA, and Orb—in predicting ...
Subah Mubassira +8 more
wiley +1 more source

In silico design of a multi-epitope vaccine against Cryptosporidium parvum using structural and immunoinformatics approaches. [PDF]

PLoS One
Sethi G, Lakra AK, Nirmal K, Hwang JH.
europepmc +1 more source

AI‐Guided Co‐Optimization of Advanced Field‐Effect Transistors: Bridging Material, Device, and Fabrication Design

Advanced Intelligent Discovery, EarlyView.
This article outlines how artificial intelligence could reshape the design of next‐generation transistors as traditional scaling reaches its limits. It discusses emerging roles of machine learning across materials selection, device modeling, and fabrication processes, and highlights hierarchical reinforcement learning as a promising framework for ...
Shoubhanik Nath +4 more
wiley +1 more source

In silico design of natural-based structures as drug candidates to inhibit ROS1 protein. [PDF]

Sci Rep
Maleki M, Fattahi A.
europepmc +1 more source

3. good health
drug design
in silico

humans
computer simulation
computational biology

computer-aided drug design
drug discovery
molecular dynamics simulation