Differences in Allosteric Communication Pipelines in the Inactive and Active States of a GPCR

Por Bhattacharya, Supriyo, Vaidehi, Nagarajan
Publicado em 2014

Internal Coordinate Molecular Dynamics: A Foundation for Multiscale Dynamics

Por Vaidehi, Nagarajan, Jain, Abhinandan
Publicado no J Phys Chem B (2014)

Allosteric Communication Pipelines in G-protein-coupled receptors

Por Vaidehi, Nagarajan, Bhattacharya, Supriyo
Publicado no Curr Opin Pharmacol (2016)

The pentamer channel stiffening model for drug action on human rhinovirus HRV-1A

Por Vaidehi, Nagarajan, Goddard, William A.
Publicado em 1997

Structural Insights into Conformational Stability of Wild-Type and Mutant β(1)-Adrenergic Receptor

Por Balaraman, Gouthaman S., Bhattacharya, Supriyo, Vaidehi, Nagarajan
Publicado em 2010

Correction

Por Balaraman, Gouthaman S., Bhattacharya, Supriyo, Vaidehi, Nagarajan
Publicado em 2010

Equipartition Principle for Internal Coordinate Molecular Dynamics

Por Jain, Abhinandan, Park, In-Hee, Vaidehi, Nagarajan
Publicado em 2012

Molecular-Dynamics Simulations of Insertion of Chemically Modified DNA Nanostructures into a Water-Chloroform Interface

Por Lin, Jianping, Seeman, Nadrian C., Vaidehi, Nagarajan
Publicado em 2008

How do mutations thermostabilize G protein-coupled receptors?

Por Vaidehi, Nagarajan, Grisshammer, Reinhard, Tate, Christopher G.
Publicado no Trends Pharmacol Sci (2015)

Folding of Small Proteins Using Constrained Molecular Dynamics

Por Balaraman, Gouthaman S., Park, In-Hee, Jain, Abhinandan, Vaidehi, Nagarajan
Publicado em 2011

Mechanism for antibody catalysis of the oxidation of water by singlet dioxygen

Por Datta, Deepshikha, Vaidehi, Nagarajan, Xu, Xin, Goddard, William A.
Publicado em 2002

Prediction of the 3D structure of rat MrgA G protein-coupled receptor and identification of its binding site

Por Heo, Jiyoung, Vaidehi, Nagarajan, Wendel, John, Goddard, William A.
Publicado em 2007

Ligand-Stabilized Conformational States of Human β(2) Adrenergic Receptor: Insight into G-Protein-Coupled Receptor Activation

Por Bhattacharya, Supriyo, Hall, Spencer E., Li, Hubert, Vaidehi, Nagarajan
Publicado em 2008

Selectivity and specificity of substrate binding in methionyl-tRNA synthetase

Por Datta, Deepshikha, Vaidehi, Nagarajan, Zhang, Deqiang, Goddard, William A.
Publicado em 2004

Conserved mechanism of conformational stability and dynamics in G-protein-coupled receptors

Por Bhattacharya, Supriyo, Salomon-Ferrer, Romelia, Lee, Sangbae, Vaidehi, Nagarajan
Publicado no J Chem Theory Comput (2016)

Fixman compensating potential for general branched molecules

Por Jain, Abhinandan, Kandel, Saugat, Wagner, Jeffrey, Larsen, Adrien, Vaidehi, Nagarajan
Publicado em 2013

Protein Structure Refinement of CASP Target Proteins Using GNEIMO Torsional Dynamics Method

Por Larsen, Adrien B., Wagner, Jeffrey R., Jain, Abhinandan, Vaidehi, Nagarajan
Publicado em 2014

Dynamic Behavior of the Active and Inactive States of the Adenosine A(2A) Receptor

Por Lee, Sangbae, Bhattacharya, Supriyo, Grisshammer, Reinhard, Tate, Christopher, Vaidehi, Nagarajan
Publicado em 2014

The stability of Seeman JX DNA topoisomers of paranemic crossover (PX) molecules as a function of crossover number

Por Maiti, Prabal K., Pascal, Tod A., Vaidehi, Nagarajan, Goddard, William A.
Publicado em 2004

Rapid Computational Prediction of Thermostabilizing Mutations for G Protein-Coupled Receptors

Por Bhattacharya, Supriyo, Lee, Sangbae, Grisshammer, Reinhard, Tate, Christopher G., Vaidehi, Nagarajan
Publicado no J Chem Theory Comput (2014)