Sentence examples for molecular dynamics program from inspiring English sources

Harnessing them effectively requires great effort, to which purpose the authors' group has developed the molecular dynamics program Not (just) Another Molecular Dynamics program (NAMD).

As an example, we present the NAMD molecular dynamics program, deployed on EGEE infrastructure.

We describe a new parallel molecular dynamics program GBMOLDD which uses the domain decomposition algorithm.

We describe a parallelised version of the MOLDY molecular dynamics program.

Recently, we have developed a new tight-binding quantum chemical molecular dynamics program "Colors" for combinatorial computational chemistry approach.

Recently we developed an accelerated quantum chemical molecular dynamics program "colors", which is approximately 5000 times faster than the first principle quantum chemical molecular dynamics calculation.

Molecular dynamics programs simulate the behavior of biomolecular systems, leading to understanding of their functions.

Specialized molecular dynamics programs, referred to as "FahCores" and often abbreviated "cores", perform the calculations on the work unit as a background process.

He was awarded with an Academic Hardware Grant from NVIDIA for a record-breaking 3D particle real-time visualization engine, and he contributed to the development of a world-leading molecular dynamics simulation program, GROMACS, focusing on GPU-based heterogeneous high performance computing algorithms and implementations.

Buckling behaviors of SWCNTs have been displayed by visual molecular dynamics (VMD) program [31].

Visualizations, manipulations, and analyses of the protein structure were carried out using the Visual Molecular Dynamics (VMD) program.