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List of works by Neysa Nevins

A critical assessment of docking programs and scoring functions

scientific article (publication date: 5 October 2006)

Allosteric Wip1 phosphatase inhibition through flap-subdomain interaction.

scientific article published on 5 January 2014

Antitumor activity of an allosteric inhibitor of centromere-associated protein-E.

scientific article

Azepanone-based inhibitors of human cathepsin S: optimization of selectivity via the P2 substituent

scientific article published on 17 June 2011

Characterization of P. falciparum dipeptidyl aminopeptidase 3 specificity identifies differences in amino acid preferences between peptide-based substrates and covalent inhibitors

scientific article published on 24 June 2019

Crossover Point between Dialkoxy Disulfides (ROSSOR) and Thionosulfites ((RO)2SS): Prediction, Synthesis, and Structure

scientific article published in 2006

D3R Grand Challenge 3: blind prediction of protein-ligand poses and affinity rankings

scientific article published on 10 January 2019

Discovery of novel cyanamide-based inhibitors of cathepsin C.

scientific article published on 10 November 2010

Druggability Assessment of Allosteric Proteins by Dynamics Simulations in the Presence of Probe Molecules

scientific article

Molecular Mechanics (MM3) Calculations on Oxygen-Containing Phosphorus (Coordination IV) Compounds

scientific article published on 01 July 1999

Molecular Shape and Medicinal Chemistry: A Perspective

scientific article

Polyoxometalate HIV-1 protease inhibitors. A new mode of protease inhibition.

scientific article

Structure activity relationships of 5-, 6-, and 7-methyl-substituted azepan-3-one cathepsin K inhibitors.

scientific article published on March 2006

The amino-acid substituents of dipeptide substrates of cathepsin C can determine the rate-limiting steps of catalysis

scientific article

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