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PySTARC
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Churn
Issues
A
examples\beta_cyclodextrin_guests\BCD_aspirin\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\carbonic_anhydrase_inhibitors\ca13_vd1269\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\ttk_inhibitors\5NAD\submit_SLURM_single_GPU.sh
 2 1
A
examples\ttk_inhibitors\3H9F\submit_SLURM_single_GPU.sh
 2 1
A
examples\ttk_inhibitors\2X9E\submit_SLURM_single_GPU.sh
 2 1
A
examples\carbonic_anhydrase_inhibitors\ca13_vd1269\submit_SLURM_single_GPU.sh
 2 1
A
examples\p38_mapk_sb203580\submit_SLURM_single_GPU.sh
 2 1
A
examples\beta_cyclodextrin_guests\BCD_1-butanol\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\thrombin_thrombomodulin\submit_SLURM_multi_GPUs.sh
 2 1
A
pystarc\analysis\fhpd.py
13 2 -
A
examples\ttk_inhibitors\5N7V\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\carbonic_anhydrase_inhibitors\ca1_vd1269\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\ttk_inhibitors\3GFW\submit_SLURM_single_GPU.sh
 2 1
A
examples\carbonic_anhydrase_inhibitors\ca1_vd1269\submit_SLURM_single_GPU.sh
 2 1
A
pystarc\global_defs\defaults.py
 2 -
A
examples\ttk_inhibitors\5N7V\submit_SLURM_single_GPU.sh
 2 1
A
examples\beta_cyclodextrin_guests\BCD_methyl_butyrate\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\beta_cyclodextrin_guests\BCD_1-naphthylethanol\submit_SLURM_multi_GPUs.sh
 2 1
A
examples\carbonic_anhydrase_inhibitors\ca2_vd1142\submit_SLURM_multi_GPUs.sh
 2 1
F
examples\ttk_inhibitors\5LJJ\setup.py
159 3 80