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Steered molecular dynamics simulations reveal critical residues for (un)binding of substrates, inhibitors and a product to the malarial M1 aminopeptidase. (2018)

First Author: Moore DS

Attributed to: Adaptive Multi-Resolution Massively-Multicore Hybrid Dynamics funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1371/journal.pcbi.1006525

PubMed Identifier: 30379805

Publication URI: http://europepmc.org/abstract/MED/30379805

Type: Journal Article/Review

Volume: 14

Parent Publication: PLoS computational biology

Issue: 10

ISSN: 1553-734X