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carlocamilloni committed Dec 20, 2023
1 parent bc7eb61 commit ce0330e
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2 changes: 1 addition & 1 deletion test/run_make_mat.sh
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@@ -1,5 +1,5 @@
set -o pipefail
tar -zxvf test_inputs/make_mat/hh.tgz -C test_inputs/make_mat/
tar -zxf test_inputs/make_mat/hh.tgz -C test_inputs/make_mat/
python ../tools/make_mat/make_mat.py --histo test_inputs/make_mat/histo --target_top test_inputs/make_mat/topol_md.top --mego_top test_inputs/make_mat/topol_ref.top --cutoff 0.75 --inter --out test_inputs/make_mat/
python ../tools/make_mat/make_mat.py --histo test_inputs/make_mat/histo --target_top test_inputs/make_mat/topol_md.top --mego_top test_inputs/make_mat/topol_ref.top --cutoff 0.75 --out test_inputs/make_mat/
diff test_inputs/make_mat/intramat_1_1.ndx test_outputs/make_mat/intramat_1_1.ndx
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2 changes: 1 addition & 1 deletion test/test_inputs/make_mat/topol_md.top
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Expand Up @@ -10,4 +10,4 @@ ATOMIC-RESOLUTION STRUCTURE OF A DOUBLET CROSS-BETA AMYLOID FIBRIL in water

[ molecules ]
; Compound #mols
Protein_chain_A 84
TTR 84

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