[gmx-users] Protein protein complex simulation to be done with respect to observe changes in temperature

SHYANTANI MAITI shyantani.maiti at gmail.com
Thu May 17 04:46:45 CEST 2018

Dear all,
Do we need to change any other parameters other than ref_t and gen_temp
should be changed if I want to perform protein protein complex md
simulation at different temperatures of the same input protein. Is it
necessary to equilibrate the average pressure value to 1 bar before running
the final md simulation?

Thanks in advance,

Best regards,
*Shyantani Maiti*

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