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Computer-aided drug design

open access: yesBMC Chemistry, 2023
AbstractComputer-Aided Drug Design tools are now an indispensable part of drug discovery that have made key contributions to the development of drugs. In this editorial, I briefly provide an overview of CADD emphasizing its potential and invite authors from academia and the pharmaceutical and biotechnology sector to present their research in this ...
Abdulilah Ece
openaire   +5 more sources

Computer-aided design and Computer-aided engineering [PDF]

open access: yesMATEC Web of Conferences, 2018
In modern industrial production some of the major factors of successful development include: cost reduction of the production, im-provement of its quality, as well as help to minimise the time in market en-try.
Kolbasin Alexander, Husu Oksana
doaj   +2 more sources

Computer-Aided Design [PDF]

open access: yesBDJ, 2018
Examples are the calculation of transmittance, reflectance, and phase as a function of wavelength, sensitivity of thin film structures to thickness and index errors, electrical field calculations, parameters for design models (equivalent indices ...
Emmanuel Maravelakis, Nicholaos Bilalis
semanticscholar   +4 more sources

Bioprinting of Multimaterials with Computer-aided Design/Computer-aided Manufacturing

open access: yesInternational Journal of Bioprinting, 2020
Multimaterials deposition, a distinct advantage in bioprinting, overcomes material’s limitation in hydrogel-based bioprinting. Multimaterials are deposited in a build/support configuration to improve the structural integrity of threedimensional bioprinted construct.
Lee, Jia Min   +2 more
openaire   +5 more sources

Integrated computer-aided engineering and design for DNA assemblies

open access: yesNature Materials, 2021
Chao-Min Huang   +2 more
exaly   +2 more sources

DeepCAD: A Deep Generative Network for Computer-Aided Design Models [PDF]

open access: yesIEEE International Conference on Computer Vision, 2021
Deep generative models of 3D shapes have received a great deal of research interest. Yet, almost all of them generate discrete shape representations, such as voxels, point clouds, and polygon meshes.
Rundi Wu, Chang Xiao, Changxi Zheng
semanticscholar   +1 more source

Engineering Sketch Generation for Computer-Aided Design [PDF]

open access: yes2021 IEEE/CVF Conference on Computer Vision and Pattern Recognition Workshops (CVPRW), 2021
Engineering sketches form the 2D basis of parametric Computer-Aided Design (CAD), the foremost modeling paradigm for manufactured objects. In this paper we tackle the problem of learning based engineering sketch generation as a first step towards ...
Karl D. D. Willis   +4 more
semanticscholar   +1 more source

Computer-Aided Drug Design and Drug Discovery: A Prospective Analysis

open access: yesPharmaceuticals, 2023
In the dynamic landscape of drug discovery, Computer-Aided Drug Design (CADD) emerges as a transformative force, bridging the realms of biology and technology.
Sarfaraz K. Niazi, Zamara Mariam
semanticscholar   +1 more source

Past, Present, and Future Perspectives on Computer-Aided Drug Design Methodologies

open access: yesMolecules, 2023
The application of computational approaches in drug discovery has been consolidated in the last decades. These families of techniques are usually grouped under the common name of “computer-aided drug design” (CADD), and they now constitute one of the ...
Davide Bassani, S. Moro
semanticscholar   +1 more source

Improving the binding affinity and interaction of 5-Pentyl-2-Phenoxyphenol against Mycobacterium Enoyl ACP reductase by computational approach

open access: yesInformatics in Medicine Unlocked, 2021
Tuberculosis (TB) is one of the leading causes of death worldwide. The development of new anti-tubercular drugs is required as resistant strains of M. tuberculosis to various first-line drugs are currently available.
Jakaria Shawon   +3 more
doaj   +1 more source

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