List of works - Barry J Grant

A posttranslational modification of the mitotic kinesin Eg5 that enhances its mechanochemical coupling and alters its mitotic function

scientific article published on 5 February 2018

A structural model for microtubule minus-end recognition and protection by CAMSAP proteins

scientific article published on 9 October 2017

A transition path ensemble study reveals a linchpin role for Mg(2+) during rate-limiting ADP release from protein kinase A.

scientific article

Accessing a hidden conformation of the maltose binding protein using accelerated molecular dynamics

scientific article

Altered chemomechanical coupling causes impaired motility of the kinesin-4 motors KIF27 and KIF7.

scientific article published on 19 January 2018

Author Correction: A structural model for microtubule minus-end recognition and protection by CAMSAP proteins

scientific article published on 30 April 2020

Bio3d: an R package for the comparative analysis of protein structures.

scientific article published on 29 August 2006

Calcium binding and allosteric signaling mechanisms for the sarcoplasmic reticulum Ca2+ ATPase ⬇️

scientific article published on October 1, 2012

Channel opening motion of alpha7 nicotinic acetylcholine receptor as suggested by normal mode analysis

scientific article published on 8 November 2005

Comparative structural dynamic analysis of GTPases

scientific article

Conformational sampling and nucleotide-dependent transitions of the GroEL subunit probed by unbiased molecular dynamics simulations

scientific article

Conformational selection in G-proteins: lessons from Ras and Rho.

scientific article published on December 2010

Domain-Opening and Dynamic Coupling in the α-Subunit of Heterotrimeric G Proteins ⬇️

scientific article published on July 16, 2013

Drug hypersensitivity caused by alteration of the MHC-presented self-peptide repertoire

scientific article

Dynamic Coupling and Allosteric Networks in the α Subunit of Heterotrimeric G Proteins.

scientific article published on 24 December 2015

Electrostatically biased binding of kinesin to microtubules

scientific article

Enrichment of druggable conformations from apo protein structures using cosolvent-accelerated molecular dynamics

scientific article published on 21 April 2015

Identification of potential small molecule binding pockets on Rho family GTPases

scientific article

Integrating protein structural dynamics and evolutionary analysis with Bio3D.

scientific article

Kinesin-5 allosteric inhibitors uncouple the dynamics of nucleotide, microtubule, and neck-linker binding sites.

scientific article

Large-scale conformational changes of Trypanosoma cruzi proline racemase predicted by accelerated molecular dynamics simulation

scientific article

LeuT conformational sampling utilizing accelerated molecular dynamics and principal component analysis

scientific article

Mapping the Processivity Determinants of the Kinesin-3 Motor Domain.

scientific article

Mapping the structural and dynamical features of kinesin motor domains

scientific article

Multivariate analysis of conserved sequence-structure relationships in kinesins: coupling of the active site and a tubulin-binding sub-domain

scientific article

Navigating the conformational landscape of G protein-coupled receptor kinases during allosteric activation.

scientific article

Novel allosteric sites on Ras for lead generation

scientific article

Novel procedure for thermal equilibration in molecular dynamics simulation

scientific article published on April 2009

Online interactive analysis of protein structure ensembles with Bio3D-web

scientific article

Rapid Characterization of Allosteric Networks with Ensemble Normal Mode Analysis

scientific article published on 8 April 2016

Ras conformational switching: simulating nucleotide-dependent conformational transitions with accelerated molecular dynamics

scientific article

Targeted molecular dynamics study of C-loop closure and channel gating in nicotinic receptors

scientific article published on 23 August 2006

The 2006 Automated Function Prediction Meeting

scientific article

The Bio3D Packages for Structural Bioinformatics

scientific article published on 30 July 2020

The distinct conformational dynamics of K-Ras and H-Ras A59G

scientific article (publication date: 2010)

sgTarget: a target selection resource for structural genomics.

scientific article published on July 2006

List of works by Barry J Grant

A posttranslational modification of the mitotic kinesin Eg5 that enhances its mechanochemical coupling and alters its mitotic function

A structural model for microtubule minus-end recognition and protection by CAMSAP proteins

A transition path ensemble study reveals a linchpin role for Mg(2+) during rate-limiting ADP release from protein kinase A.

Accessing a hidden conformation of the maltose binding protein using accelerated molecular dynamics

Altered chemomechanical coupling causes impaired motility of the kinesin-4 motors KIF27 and KIF7.

Author Correction: A structural model for microtubule minus-end recognition and protection by CAMSAP proteins

Bio3d: an R package for the comparative analysis of protein structures.

Calcium binding and allosteric signaling mechanisms for the sarcoplasmic reticulum Ca2+ ATPase ⬇️

Channel opening motion of alpha7 nicotinic acetylcholine receptor as suggested by normal mode analysis

Comparative structural dynamic analysis of GTPases

Conformational sampling and nucleotide-dependent transitions of the GroEL subunit probed by unbiased molecular dynamics simulations

Conformational selection in G-proteins: lessons from Ras and Rho.

Domain-Opening and Dynamic Coupling in the α-Subunit of Heterotrimeric G Proteins ⬇️

Drug hypersensitivity caused by alteration of the MHC-presented self-peptide repertoire

Dynamic Coupling and Allosteric Networks in the α Subunit of Heterotrimeric G Proteins.

Electrostatically biased binding of kinesin to microtubules

Enrichment of druggable conformations from apo protein structures using cosolvent-accelerated molecular dynamics

Identification of potential small molecule binding pockets on Rho family GTPases

Integrating protein structural dynamics and evolutionary analysis with Bio3D.

Kinesin-5 allosteric inhibitors uncouple the dynamics of nucleotide, microtubule, and neck-linker binding sites.

Large-scale conformational changes of Trypanosoma cruzi proline racemase predicted by accelerated molecular dynamics simulation

LeuT conformational sampling utilizing accelerated molecular dynamics and principal component analysis

Mapping the Processivity Determinants of the Kinesin-3 Motor Domain.

Mapping the structural and dynamical features of kinesin motor domains

Multivariate analysis of conserved sequence-structure relationships in kinesins: coupling of the active site and a tubulin-binding sub-domain

Navigating the conformational landscape of G protein-coupled receptor kinases during allosteric activation.

Novel allosteric sites on Ras for lead generation

Novel procedure for thermal equilibration in molecular dynamics simulation

Online interactive analysis of protein structure ensembles with Bio3D-web

Rapid Characterization of Allosteric Networks with Ensemble Normal Mode Analysis

Ras conformational switching: simulating nucleotide-dependent conformational transitions with accelerated molecular dynamics

Targeted molecular dynamics study of C-loop closure and channel gating in nicotinic receptors

The 2006 Automated Function Prediction Meeting

The Bio3D Packages for Structural Bioinformatics

The distinct conformational dynamics of K-Ras and H-Ras A59G

sgTarget: a target selection resource for structural genomics.