2 Works

Data from: Release of 50 new, drug-like compounds and their computational target predictions for open source anti-tubercular drug discovery

Maria Jose Rebollo-Lopez, Joel Lelievre, Francisco Martínez-Jiménez, Marc A. Marti-Renom, George Papadatos, Grace Mugumbate & John P. Overington
As a follow up to the antimycobacterial screening exercise and the release of GSK´s first Tres Cantos Antimycobacterial Set (TCAMS-TB), this paper presents the results of a second antitubercular screening effort of two hundred and fifty thousand compounds recently added to the GSK collection. The compounds were further prioritized based on not only antitubercular potency but also on physicochemical characteristics. The 50 most attractive compounds were then progressed for evaluation in three different predictive computational...

Data from: Current methods for automated filtering of multiple sequence alignments frequently worsen single-gene phylogenetic inference

Ge Tan, Matthieu Muffato, Christian Ledergerber, Javier Herrero, Nick Goldman, Manuel Gil & Christophe Dessimoz
Phylogenetic inference is generally performed on the basis of multiple sequence alignments (MSA). Because errors in an alignment can lead to errors in tree estimation, there is a strong interest in identifying and removing unreliable parts of the alignment. In recent years several automated filtering approaches have been proposed, but despite their popularity, a systematic and comprehensive comparison of different alignment filtering methods on real data has been lacking. Here, we extend and apply recently...

Registration Year

  • 2015
    2

Resource Types

  • Dataset
    2

Affiliations

  • European Bioinformatics Institute
    2
  • University of Zurich
    1
  • Institució Catalana de Recerca i Estudis Avançats
    1
  • Centre for Genomic Regulation
    1
  • GlaxoSmithKline (Spain)
    1
  • Swiss Federal Institute of Technology in Zurich
    1