User: syedazeemullah186

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What is the basis of inputting the emtol parameter in the minim.mdp?
... My protein has 596 residues that I'm trying to simulate in GROMACS 5.1. Can anyone explain the basis of input parameters for energy minimization? The maximum no. of EM steps? emtol? ...
gromacs energy minimization written 2.4 years ago by syedazeemullah1860

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