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List of works by Rachael Mansbach

A Fragment Library for Drug Activity in Gram Negative Bacteria

article published in 2019

A Patchy Particle Model of the Hierarchical Self-Assembly of π-Conjugated Optoelectronic Peptides

article

Coarse-Grained Molecular Simulation of the Hierarchical Self-Assembly of π-Conjugated Optoelectronic Peptides

scientific article published on 24 January 2017

Combinatorial diversity of Syk recruitment driven by its multivalent engagement with FcεRIγ

scientific article published on 19 June 2019

Control of the hierarchical assembly of π-conjugated optoelectronic peptides by pH and flow

scientific article published on 24 May 2017

Discovery of Self-Assembling π-Conjugated Peptides by Active Learning-Directed Coarse-Grained Molecular Simulation

scientific article published on 30 March 2020

Graph-Directed Approach for Downselecting Toxins for Experimental Structure Determination

scientific article published on 14 May 2020

Helical antimicrobial polypeptides with radial amphiphilicity

scientific article

Machine Learning Algorithm Identifies an Antibiotic Vocabulary for Permeating Gram-Negative Bacteria

scientific article published on 26 May 2020

Machine learning of single molecule free energy surfaces and the impact of chemistry and environment upon structure and dynamics.

scientific article published in March 2015

Modulation of polypeptide conformation through donor-acceptor transformation of side-chain hydrogen bonding ligands

scientific article published on 21 July 2017

Patchy Particle Model of the Hierarchical Self-Assembly of π-Conjugated Optoelectronic Peptides

Snails In Silico: A Review of Computational Studies on the Conopeptides.

scientific article

The SARS-CoV-2 Spike Variant D614G Favors an Open Conformational State

scientific article published on 26 July 2020

The SARS-CoV-2 Spike variant D614G favors an open conformational state

WORK IN PROGRESS: Computational Modules for the MatSE Undergraduate Curriculum

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