[gmx-users] difference in kinetic energy

Emran Heshmati compbioph at gmail.com
Sun Jun 25 00:26:43 CEST 2017


Dear Gromacs users
I performed alanine scaning mutagenesis using gromacs on a peptide fragment
consisting 16 aa. In one of the mutations, the kinetic energy of the system
was significantly different. How can I interpret this result? any comment
is welcome
regards


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