Cargando…
DesMol2, an Effective Tool for the Construction of Molecular Libraries and Its Application to QSAR Using Molecular Topology
A web application, DesMol2, which offers two main functionalities, is presented: the construction of molecular libraries and the calculation of topological indices. These functionalities are explained through a practical example of research of active molecules to the formylpeptide receptor (FPR), a...
Autores principales: | García-Pereira, Inma, Zanni, Riccardo, Galvez-Llompart, Maria, Galvez, Jorge, García-Domenech, Ramón |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2019
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6413007/ https://www.ncbi.nlm.nih.gov/pubmed/30781706 http://dx.doi.org/10.3390/molecules24040736 |
Ejemplares similares
-
Molecular Topology QSAR Strategy for Crop Protection:
New Natural Fungicides with Chitin Inhibitory Activity
por: Galvez-Llompart, Maria, et al.
Publicado: (2020) -
Modeling Natural Anti-Inflammatory Compounds by Molecular Topology
por: Galvez-Llompart, María, et al.
Publicado: (2011) -
Alzheimer: A Decade of Drug Design. Why Molecular Topology can be an Extra Edge
por: Zanni, Riccardo, et al.
Publicado: (2018) -
How Molecular Topology Can Help in Amyotrophic Lateral Sclerosis (ALS) Drug Development: A Revolutionary Paradigm for a Merciless Disease
por: Galvez-Llompart, Maria, et al.
Publicado: (2022) -
Rational Design of Chitin Deacetylase Inhibitors for
Sustainable Agricultural Use Based on Molecular Topology
por: Zanni, Riccardo, et al.
Publicado: (2022)