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GSATools addresses the need for automated functional analysis emerging from the wealth of molecular simulations currently available in the scientific community.
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I tear through initially unfamiliar papers on Quantum Key Distributions, a potential method of encryption using quantum computing, and quantum algorithms, banking on exponentially increased computing power to tackle the most currently intractable problems, from molecular simulations to climate change models to stock market prediction for systemic risk.
Force-fields currently used in atomistic molecular simulations differ in the way they are parameterized.
The detailed pictures of molecular events visualized by molecular simulations are by and large impossible to elucidate using currently available experimental techniques.
This is currently being done with great accuracy using molecular simulations.
K.J. conceived the modelling strategy and performed the molecular simulations.
Algorithms of molecular simulations and underlying theories.
The molecular simulations were run using a modified version of Gromacs 4.0.551.
Zhang, L., Borthakur, S. & Buck, M. Dissociation of a dynamic protein complex studied by all-atom molecular simulations.
The reasonable compliance between experimental results and molecular simulations of single-molecule pulling38 is noteworthy, especially considering the simplified nature of the simulations.
A serial entrepreneur and tech company executive whose PhD research had focused on molecular simulations.
Write better and faster with AI suggestions while staying true to your unique style.
Since I tried Ludwig back in 2017, I have been constantly using it in both editing and translation. Ever since, I suggest it to my translators at ProSciEditing.

Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com