Steve Plimpton 1d86b3e270 reading of bitorsion data file

2022-03-14 18:08:14 -06:00

..

amoeba_ubiquitin.key

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

amoeba_ubiquitin.prm

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

amoeba_water.key

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

amoeba_water.prm

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

bitorsion.ubiquitin.data

reading of bitorsion data file

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data.ubiquitin

reading of bitorsion data file

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data.water_box.amoeba

fix example problems

2021-08-26 15:09:27 -06:00

data.water_box.hippo

fix example problems

2021-08-26 15:09:27 -06:00

data.water_dimer.amoeba

fix example problems

2021-08-26 15:09:27 -06:00

data.water_dimer.hippo

fix example problems

2021-08-26 15:09:27 -06:00

data.water_hexamer.amoeba

fix example problems

2021-08-26 15:09:27 -06:00

data.water_hexamer.hippo

fix example problems

2021-08-26 15:09:27 -06:00

hippo_water.key

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

hippo_water.prm

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

in.ubiquitin

reading of bitorsion data file

2022-03-14 18:08:14 -06:00

in.water_box.amoeba

changed bookkeeping of forces

2022-03-10 16:41:58 -07:00

in.water_box.hippo

changed bookkeeping of forces

2022-03-10 16:41:58 -07:00

in.water_dimer.amoeba

changed bookkeeping of forces

2022-03-10 16:41:58 -07:00

in.water_dimer.hippo

changed bookkeeping of forces

2022-03-10 16:41:58 -07:00

in.water_hexamer.amoeba

changed bookkeeping of forces

2022-03-10 16:41:58 -07:00

in.water_hexamer.hippo

changed bookkeeping of forces

2022-03-10 16:41:58 -07:00

ubiquitin.xyz

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

water_box.xyz

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

water_dimer.xyz

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00

water_hexamer.xyz

initial version of AMOEBA/HIPPO force field files

2021-08-25 13:53:31 -06:00