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Remove flag from test input that was absent in reference run
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In that code version, distanceVec was not yet honoring forceNoPBC
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@giacomofiorin
giacomofiorin committed Dec 5, 2023
1 parent 4e10b4d commit 16b234e
Showing 1 changed file with 0 additions and 40 deletions.
40 changes: 0 additions & 40 deletions namd/tests/library/033_apathCV_distanceVec_derivatives/apath.in
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Original file line number Diff line number Diff line change
Expand Up @@ -9,7 +9,6 @@ colvar {
distanceVec {
name 002
componentCoeff 0.6
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -19,7 +18,6 @@ colvar {
}
distanceVec {
name 005
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -29,7 +27,6 @@ colvar {
}
distanceVec {
name 006
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -39,7 +36,6 @@ colvar {
}
distanceVec {
name 007
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -49,7 +45,6 @@ colvar {
}
distanceVec {
name 009
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -59,7 +54,6 @@ colvar {
}
distanceVec {
name 011
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -69,7 +63,6 @@ colvar {
}
distanceVec {
name 015
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -79,7 +72,6 @@ colvar {
}
distanceVec {
name 016
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -89,7 +81,6 @@ colvar {
}
distanceVec {
name 017
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -99,7 +90,6 @@ colvar {
}
distanceVec {
name 019
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -109,7 +99,6 @@ colvar {
}
distanceVec {
name 021
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -119,7 +108,6 @@ colvar {
}
distanceVec {
name 025
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -129,7 +117,6 @@ colvar {
}
distanceVec {
name 026
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -139,7 +126,6 @@ colvar {
}
distanceVec {
name 027
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -149,7 +135,6 @@ colvar {
}
distanceVec {
name 029
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -159,7 +144,6 @@ colvar {
}
distanceVec {
name 031
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -169,7 +153,6 @@ colvar {
}
distanceVec {
name 035
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -179,7 +162,6 @@ colvar {
}
distanceVec {
name 036
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -189,7 +171,6 @@ colvar {
}
distanceVec {
name 037
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -199,7 +180,6 @@ colvar {
}
distanceVec {
name 039
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -219,7 +199,6 @@ colvar {
debugGradients on
distanceVec {
name 002
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -229,7 +208,6 @@ colvar {
}
distanceVec {
name 005
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -239,7 +217,6 @@ colvar {
}
distanceVec {
name 006
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -249,7 +226,6 @@ colvar {
}
distanceVec {
name 007
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -259,7 +235,6 @@ colvar {
}
distanceVec {
name 009
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -269,7 +244,6 @@ colvar {
}
distanceVec {
name 011
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -279,7 +253,6 @@ colvar {
}
distanceVec {
name 015
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -289,7 +262,6 @@ colvar {
}
distanceVec {
name 016
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -299,7 +271,6 @@ colvar {
}
distanceVec {
name 017
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -309,7 +280,6 @@ colvar {
}
distanceVec {
name 019
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -319,7 +289,6 @@ colvar {
}
distanceVec {
name 021
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -329,7 +298,6 @@ colvar {
}
distanceVec {
name 025
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -339,7 +307,6 @@ colvar {
}
distanceVec {
name 026
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -349,7 +316,6 @@ colvar {
}
distanceVec {
name 027
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -359,7 +325,6 @@ colvar {
}
distanceVec {
name 029
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -369,7 +334,6 @@ colvar {
}
distanceVec {
name 031
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -379,7 +343,6 @@ colvar {
}
distanceVec {
name 035
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -389,7 +352,6 @@ colvar {
}
distanceVec {
name 036
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -399,7 +361,6 @@ colvar {
}
distanceVec {
name 037
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
Expand All @@ -409,7 +370,6 @@ colvar {
}
distanceVec {
name 039
forceNoPBC yes
group1 {
dummyAtom (0.00, 0.00, 0.00)
}
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