AIMC Topic: Computer-Aided Design

Clear Filters Showing 91 to 100 of 171 articles

On Design Mining: Coevolution and Surrogate Models.

Artificial life May 17, 2017
Design mining is the use of computational intelligence techniques to iteratively search and model the attribute space of physical objects evaluated directly through rapid prototyping to meet given objectives. It enables the exploitation of novel mate...
Power Plants Energy-Generating Resources Artificial Intelligence Computer-Aided Design
View on PubMed DOI

A preliminary investigation into the design of pressure cushions and their potential applications for forearm robotic orthoses.

Biomedical engineering online May 8, 2017
BACKGROUND: Load cells are often used in rehabilitation robotics to monitor human-robot interaction. While load cells are accurate and suitable for the stationary end-point robots used in rehabilitation hospitals, their cost and inability to conform ...
Pilot Projects Robotics Equipment Design Pressure Humans Reproducibility of Results Sensitivity and Specificity Computer-Aided Design Orthotic Devices Exoskeleton Device Man-Machine Systems Manometry Transducers, Pressure Equipment Failure Analysis Forearm
View on PubMed DOI

Design and Characterization of a Quasi-Passive Pneumatic Foot-Ankle Prosthesis.

IEEE transactions on neural systems and rehabilitation engineering : a publication of the IEEE Engineering in Medicine and Biology Society Apr 28, 2017
The majority of commercially available passive prosthetic feet are not capable of providing joint mechanics that match that of the intact human ankle. Due to their cantilever design, their stiffness characteristics contrast with what has been observe...
Humans Reproducibility of Results Biomimetics Ankle Joint Equipment Failure Analysis Joint Prosthesis Air Pressure Exoskeleton Device Robotics Sensitivity and Specificity Amputees Equipment Design Middle Aged Artificial Limbs Computer-Aided Design
View on PubMed DOI

Bayesian molecular design with a chemical language model.

Journal of computer-aided molecular design Mar 9, 2017
The aim of computational molecular design is the identification of promising hypothetical molecules with a predefined set of desired properties. We address the issue of accelerating the material discovery with state-of-the-art machine learning techni...
Bayes Theorem Models, Chemical Pharmaceutical Preparations Monte Carlo Method Computer-Aided Design Drug Design Molecular Structure Small Molecule Libraries Software Computer Simulation Machine Learning
View on PubMed DOI

Creating the New from the Old: Combinatorial Libraries Generation with Machine-Learning-Based Compound Structure Optimization.

Journal of chemical information and modeling Feb 15, 2017
The growing computational abilities of various tools that are applied in the broadly understood field of computer-aided drug design have led to the extreme popularity of virtual screening in the search for new biologically active compounds. Most ofte...
Machine Learning Computer-Aided Design Databases, Pharmaceutical Combinatorial Chemistry Techniques Drug Design Small Molecule Libraries
View on PubMed DOI

Predicting DPP-IV inhibitors with machine learning approaches.

Journal of computer-aided molecular design Feb 2, 2017
Dipeptidyl peptidase IV (DPP-IV) is a promising Type 2 diabetes mellitus (T2DM) drug target. DPP-IV inhibitors prolong the action of glucagon-like peptide-1 (GLP-1) and gastric inhibitory peptide (GIP), improve glucose homeostasis without weight gain...
Bayes Theorem Dipeptidyl Peptidase 4 Small Molecule Libraries Dipeptidyl-Peptidase IV Inhibitors Computer-Aided Design Drug Design Diabetes Mellitus, Type 2 Humans Machine Learning Molecular Docking Simulation
View on PubMed DOI

Machine learning and docking models for Mycobacterium tuberculosis topoisomerase I.

Tuberculosis (Edinburgh, Scotland) Jan 20, 2017
There is a shortage of compounds that are directed towards new targets apart from those targeted by the FDA approved drugs used against Mycobacterium tuberculosis. Topoisomerase I (Mttopo I) is an essential mycobacterial enzyme and a promising target...
Machine Learning Molecular Docking Simulation Computer-Aided Design Structure-Activity Relationship Bayes Theorem Drug Design Dose-Response Relationship, Drug Humans Molecular Targeted Therapy Topoisomerase I Inhibitors Protein Conformation Antitubercular Agents Mycobacterium smegmatis Tuberculosis DNA Topoisomerases, Type I Mycobacterium tuberculosis
View on PubMed DOI

Boosting Docking-Based Virtual Screening with Deep Learning.

Journal of chemical information and modeling Nov 29, 2016
In this work, we propose a deep learning approach to improve docking-based virtual screening. The deep neural network that is introduced, DeepVS, uses the output of a docking program and learns how to extract relevant features from basic data such as...
ROC Curve Humans Proteins Neural Networks, Computer Ligands Molecular Docking Simulation Software Computer-Aided Design Algorithms Drug Design
View on PubMed DOI

Using Self-Reliance Factors to Decide How to Share Control Between Human Powered Wheelchair Drivers and Ultrasonic Sensors.

IEEE transactions on neural systems and rehabilitation engineering : a publication of the IEEE Engineering in Medicine and Biology Society Oct 25, 2016
A shared-control scheme for a powered wheelchair is presented. The wheelchair can be operated by a wheelchair driver using a joystick, or directed by a sensor system, or control can be combined between them. The wheelchair system can modify direction...
Equipment Design Motor Skills Equipment Failure Analysis Humans Man-Machine Systems Computer-Aided Design Reproducibility of Results Persons with Disabilities Sensitivity and Specificity Wheelchairs Ultrasonography Robotics Feedback Transducers Personal Autonomy Decision Making, Computer-Assisted
View on PubMed DOI

ROCS-derived features for virtual screening.

Journal of computer-aided molecular design Sep 8, 2016
Rapid overlay of chemical structures (ROCS) is a standard tool for the calculation of 3D shape and chemical ("color") similarity. ROCS uses unweighted sums to combine many aspects of similarity, yielding parameter-free models for virtual screening. I...
Pharmaceutical Preparations Drug Design Machine Learning Models, Molecular Algorithms Molecular Structure Computer-Aided Design
View on PubMed DOI
Popular Topics
Recent Journals