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Hello. I run 40 ns MD Simulation and trying to employ tcaf module of Gromacs to evalaute the shear viscosity. Shortage of memory does not allow me to get the value in my system. Energy moduel...
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I want to perform MD Simulation of Ionic compounds in Gromacs but facing problems at various points. One of my approaches of the work is submitting the pdb files of the cations and anions to ATB...
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