Wird geladen...

Template-based combinatorial enumeration of virtual compound libraries for lipids

A variety of software packages are available for the combinatorial enumeration of virtual libraries for small molecules, starting from specifications of core scaffolds with attachments points and lists of R-groups as SMILES or SD files. Although SD files include atomic coordinates for core scaffolds...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Hauptverfasser: Sud, Manish, Fahy, Eoin, Subramaniam, Shankar
Format: Artigo
Sprache:Inglês
Veröffentlicht: BioMed Central 2012
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3545849/
https://ncbi.nlm.nih.gov/pubmed/23006594
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-4-23
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!