fireball_12.11_amber_14_ambertools_15
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fireball_12.11_amber_14_ambertools_15 [2017/03/04 01:01] dani |
fireball_12.11_amber_14_ambertools_15 [2017/03/04 01:19] dani |
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| - | -Compile amber14 with AmberTools 15 | + | * Compile amber14 with AmberTools 15 |
| - | -Download Fireball library and script | + | * Download Fireball library and script [[http://fireball.ftmc.uam.es/make_fireball_qmmm.tar.gz]] |
| - | -Download Fdata for HCNO | + | * Download Fdata for HCNO [[http://fireball.ftmc.uam.es/Fdata_HCNO.tar.gz]] |
| - | -Change the config.h file and (make serial) in sander folder. | + | * Change the config.h file and (make serial) in sander folder. |
| cd amber14 | cd amber14 | ||
fireball_12.11_amber_14_ambertools_15.txt · Last modified: 2017/03/04 01:19 (external edit)
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