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Fix test after alchemical solvent template changes
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@martimunicoy
martimunicoy committed May 8, 2023
1 parent e8fecea commit 17f963f
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Showing 3 changed files with 48 additions and 48 deletions.
22 changes: 11 additions & 11 deletions peleffy/data/tests/alchemical_ligandParams_0.txt
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Original file line number Diff line number Diff line change
Expand Up @@ -85,47 +85,47 @@
"scale": 0.85
},
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}
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48 changes: 24 additions & 24 deletions peleffy/data/tests/alchemical_ligandParams_1.txt
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Original file line number Diff line number Diff line change
Expand Up @@ -21,23 +21,23 @@
"scale": 0.755
},
"_C3_": {
"radius": 0.85,
"radius": 1.7,
"scale": 0.36
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"_C4_": {
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"_H1_": {
Expand All @@ -49,83 +49,83 @@
"scale": 0.85
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}
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26 changes: 13 additions & 13 deletions peleffy/data/tests/alchemical_ligandParams_2.txt
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Original file line number Diff line number Diff line change
Expand Up @@ -21,23 +21,23 @@
"scale": 0.79
},
"_C3_": {
"radius": 0.0,
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"_H1_": {
Expand All @@ -49,39 +49,39 @@
"scale": 0.85
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"_C6_": {
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