fireball_12.11_amber_14_ambertools_15
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fireball_12.11_amber_14_ambertools_15 [2017/03/04 01:09] dani |
fireball_12.11_amber_14_ambertools_15 [2017/03/04 01:19] (current) |
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| * Compile amber14 with AmberTools 15 | * Compile amber14 with AmberTools 15 | ||
| * Download Fireball library and script [[http://fireball.ftmc.uam.es/make_fireball_qmmm.tar.gz]] | * 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. | ||
fireball_12.11_amber_14_ambertools_15.txt ยท Last modified: 2017/03/04 01:19 (external edit)
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