Lataa...

D3R Grand Challenge 4: Ligand similarity and MM-GBSA-based pose prediction and affinity ranking for BACE-1 inhibitors

The Drug Design Data Resource (D3R) Grand Challenges present an opportunity to assess, in the context of a blind predictive challenge, the accuracy and the limits of tools and methodologies designed to help guide pharmaceutical drug discovery projects. Here, we report the results of our participatio...

Täydet tiedot

Tallennettuna:
Bibliografiset tiedot
Julkaisussa:J Comput Aided Mol Des
Päätekijät: Sasmal, Sukanya, Khoury, Léa El, Mobley, David L.
Aineistotyyppi: Artigo
Kieli:Inglês
Julkaistu: 2019
Aiheet:
Linkit:https://ncbi.nlm.nih.gov/pmc/articles/PMC8208075/
https://ncbi.nlm.nih.gov/pubmed/31781990
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-019-00249-1
Tagit: Lisää tagi
Ei tageja, Lisää ensimmäinen tagi!