Cargando…
Open-Source Browser-Based Tools for Structure-Based Computer-Aided Drug Discovery
We here outline the importance of open-source, accessible tools for computer-aided drug discovery (CADD). We begin with a discussion of drug discovery in general to provide context for a subsequent discussion of structure-based CADD applied to small-molecule ligand discovery. Next, we identify usabi...
Autores principales: | Wang, Ann, Durrant, Jacob D. |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9319651/ https://www.ncbi.nlm.nih.gov/pubmed/35889494 http://dx.doi.org/10.3390/molecules27144623 |
Ejemplares similares
-
DeepFrag: An Open-Source Browser App for Deep-Learning
Lead Optimization
por: Green, Harrison, et al.
Publicado: (2021) -
Webina: an open-source library and web app that runs AutoDock Vina entirely in the web browser
por: Kochnev, Yuri, et al.
Publicado: (2020) -
PCAViz: An Open-Source Python/JavaScript Toolkit for
Visualizing Molecular Dynamics Simulations in the Web Browser
por: Pacheco, Sayuri, et al.
Publicado: (2019) -
Aequatus: an open-source homology browser
por: Thanki, Anil S, et al.
Publicado: (2018) -
Drug Discovery for Mycobacterium tuberculosis Using Structure-Based Computer-Aided Drug Design Approach
por: Ejalonibu, Murtala A., et al.
Publicado: (2021)