Back-Jump Probabilities: Get Normalization Factors #142
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Use the new command-line option of the MDTool script `back_jump_prob_discrete.py`, `--norm-out`, to receive an output file with the normalization factors used to calculate the back-jump probabilities (see andthum/mdtools#201).
…actors Use the new command-line option of the MDTool script `back_jump_prob_discrete.py`, `--norm-out`, to receive an output file with the normalization factors used to calculate the back-jump probabilities (see andthum/mdtools#201).
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Back-Jump Probabilities: Get Normalization Factors
Type of Change
Proposed Changes
Slurm job scripts
discrete-z_Li_back_jump_prob_discrete.sh,renewal_events_Li-ether_back_jump_prob_discrete.shandrenewal_events_Li-NTf2_back_jump_prob_discrete.sh: Use the new command-line option of the MDTool scriptback_jump_prob_discrete.py,--norm-out, to receive an output file with the normalization factors used to calculate the back-jump probabilities (see andthum/mdtools#201).PR Checklist