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Dispersion #16

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Dispersion #16

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Commits on Feb 3, 2023

  1. Create 4709418_pdb_path.sh

    @vganapati
    vganapati committed Feb 3, 2023
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Commits on Feb 8, 2023

  1. Create small_example.sh

    @vganapati
    vganapati committed Feb 8, 2023
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  2. Update small_example.sh

    @vganapati
    vganapati committed Feb 8, 2023
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  3. Update small_example.sh

    @vganapati
    vganapati committed Feb 8, 2023
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  4. Update small_example.sh

    @vganapati
    vganapati committed Feb 8, 2023
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  5. Update small_example.sh

    @vganapati
    vganapati committed Feb 8, 2023
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  6. Update small_example.sh

    @vganapati
    vganapati committed Feb 8, 2023
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Commits on Feb 9, 2023

  1. Update 4709418_pdb_path.sh 

    Increase time
    @vganapati
    vganapati committed Feb 9, 2023
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Commits on Feb 14, 2023

  1. updated 4709418 with SIT_DATA and SIT_ROOT

    @vganapati
    vganapati committed Feb 14, 2023
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  2. removed pdb_path version of script

    @vganapati
    vganapati committed Feb 14, 2023
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Commits on Feb 18, 2023

  1. Update small_example.sh

    @vganapati
    vganapati committed Feb 18, 2023
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  2. Update 3724210.sh

    @vganapati
    vganapati committed Feb 18, 2023
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Commits on Feb 21, 2023

  1. Update phil.py

    @vganapati
    vganapati committed Feb 21, 2023
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  2. Update 3762323.sh

    @vganapati
    vganapati committed Feb 21, 2023
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  3. Update phil.py

    @vganapati
    vganapati committed Feb 21, 2023
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Commits on Feb 22, 2023

  1. Adding weighting_factor to weight the kramers_kronig penalty

    @vganapati
    vganapati committed Feb 22, 2023
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  2. step 11 scripts

    @vganapati
    vganapati committed Feb 22, 2023
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Commits on Feb 25, 2023

  1. Update small_example.sh

    @vganapati
    vganapati committed Feb 25, 2023
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  2. updated energy stride

    @vganapati
    vganapati committed Feb 25, 2023
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Commits on Feb 26, 2023

  1. Update 3762323.sh 

    Decreased stride
    @vganapati
    vganapati committed Feb 26, 2023
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  2. Create step11_params3.sh

    @vganapati
    vganapati committed Feb 26, 2023
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Commits on Feb 28, 2023

  1. parameter sweeps

    @vganapati
    vganapati committed Feb 28, 2023
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Commits on Mar 1, 2023

  1. added params files

    @vganapati
    vganapati committed Mar 1, 2023
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Commits on Mar 2, 2023

  1. removed extraneous scripts

    @vganapati
    vganapati committed Mar 2, 2023
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  2. Update 3762323.sh

    @vganapati
    vganapati committed Mar 2, 2023
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  3. renamed step11 script

    @vganapati
    vganapati committed Mar 2, 2023
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Commits on Mar 5, 2023

  1. Update README.md

    @nksauter
    nksauter authored Mar 5, 2023
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