# | Line 184 | Line 184 | program nano | |
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184 | #endif | |
185 | ||
186 | ||
187 | < | if(checktemp.or.(ensemble == 'NVT')) then |
187 | > | if(command == 'setup') then |
188 | call randomize_velocities(target_temp) | |
189 | end if | |
190 | ||
191 | ||
192 | + | |
193 | call run_dynamics() | |
194 | ||
195 | call write_final_config() |
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