Anu George
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View article: Review of Electrostatic Force Calculation Methods and Their Acceleration in Molecular Dynamics Packages Using Graphics Processors
Review of Electrostatic Force Calculation Methods and Their Acceleration in Molecular Dynamics Packages Using Graphics Processors Open
Molecular dynamics (MD) simulations probe the conformational repertoire of macromolecular systems using Newtonian dynamic equations. The time scales of MD simulations allow the exploration of biologically relevant phenomena and can elucida…
View article: Laplacian score and genetic algorithm based automatic feature selection for Markov State Models in adaptive sampling based molecular dynamics
Laplacian score and genetic algorithm based automatic feature selection for Markov State Models in adaptive sampling based molecular dynamics Open
Adaptive sampling molecular dynamics based on Markov State Models use short parallel MD simulations to accelerate simulations, and are proven to identify hidden conformers. The accuracy of the predictions provided by it depends on the feat…
View article: GTT-1-protein-137.dcdWW domain trajectories
GTT-1-protein-137.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-224.dcdWW domain trajectories
GTT-1-protein-224.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-161.dcdWW domain trajectories
GTT-1-protein-161.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-248.dcdWW domain trajectories
GTT-1-protein-248.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-218.dcdWW domain trajectories
GTT-1-protein-218.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-268.dcdWW domain trajectories
GTT-1-protein-268.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-233.dcdWW domain trajectories
GTT-1-protein-233.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-286.dcdWW domain trajectories
GTT-1-protein-286.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-199.dcdWW domain trajectories
GTT-1-protein-199.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-180.dcdWW domain trajectories
GTT-1-protein-180.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-272.dcdWW domain trajectories
GTT-1-protein-272.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-169.dcdWW domain trajectories
GTT-1-protein-169.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-304.dcdWW domain trajectories
GTT-1-protein-304.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-301.dcdWW domain trajectories
GTT-1-protein-301.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-292.dcdWW domain trajectories
GTT-1-protein-292.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-203.dcdWW domain trajectories
GTT-1-protein-203.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-266.dcdWW domain trajectories
GTT-1-protein-266.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-258.dcdWW domain trajectories
GTT-1-protein-258.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-244.dcdWW domain trajectories
GTT-1-protein-244.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-209.dcdWW domain trajectories
GTT-1-protein-209.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-293.dcdWW domain trajectories
GTT-1-protein-293.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-260.dcdWW domain trajectories
GTT-1-protein-260.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-294.dcdWW domain trajectories
GTT-1-protein-294.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-205.dcdWW domain trajectories
GTT-1-protein-205.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-311.dcdWW domain trajectories
GTT-1-protein-311.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-163.dcdWW domain trajectories
GTT-1-protein-163.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-164.dcdWW domain trajectories
GTT-1-protein-164.dcdWW domain trajectories Open
Trajectories of ww domain
View article: GTT-1-protein-211.dcdWW domain trajectories
GTT-1-protein-211.dcdWW domain trajectories Open
Trajectories of ww domain