Target specific proteochemometric model development for BACE1 – protein flexibility and structural water are critical in virtual screening
Author:
Affiliation:
1. Structural Biology and Bioinformatics Division
2. CSIR-Indian Institute of Chemical Biology
3. Kolkata 700032
4. India
5. National Institute of Pharmaceutical Education and Research
Abstract
Structural water and protein plasticity are important factors for BACE1 targeted ligand virtual screening.
Funder
Council of Scientific and Industrial Research
Publisher
Royal Society of Chemistry (RSC)
Subject
Molecular Biology,Biotechnology
Link
http://pubs.rsc.org/en/content/articlepdf/2015/MB/C5MB00088B
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