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OpenDAS
torchani
Commits
a2ba46e9
Commit
a2ba46e9
authored
Aug 07, 2019
by
Farhad Ramezanghorbani
Committed by
Gao, Xiang
Aug 07, 2019
Browse files
Remove the first layer's weight decay parameters of each atomic network (#279)
parent
25dd28bb
Changes
18
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18 changed files
with
0 additions
and
144 deletions
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-144
tests/test_data/inputtrain.ipt
tests/test_data/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train0/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train0/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train1/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train1/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train2/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train2/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train3/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train3/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train4/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train4/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train5/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train5/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train6/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train6/inputtrain.ipt
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torchani/resources/ani-1ccx_8x/train7/inputtrain.ipt
torchani/resources/ani-1ccx_8x/train7/inputtrain.ipt
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torchani/resources/ani-1x_8x/inputtrain.ipt
torchani/resources/ani-1x_8x/inputtrain.ipt
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torchani/resources/ani-1x_8x/train0/inputtrain.ipt
torchani/resources/ani-1x_8x/train0/inputtrain.ipt
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torchani/resources/ani-1x_8x/train1/inputtrain.ipt
torchani/resources/ani-1x_8x/train1/inputtrain.ipt
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torchani/resources/ani-1x_8x/train2/inputtrain.ipt
torchani/resources/ani-1x_8x/train2/inputtrain.ipt
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torchani/resources/ani-1x_8x/train3/inputtrain.ipt
torchani/resources/ani-1x_8x/train3/inputtrain.ipt
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torchani/resources/ani-1x_8x/train4/inputtrain.ipt
torchani/resources/ani-1x_8x/train4/inputtrain.ipt
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torchani/resources/ani-1x_8x/train5/inputtrain.ipt
torchani/resources/ani-1x_8x/train5/inputtrain.ipt
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torchani/resources/ani-1x_8x/train6/inputtrain.ipt
torchani/resources/ani-1x_8x/train6/inputtrain.ipt
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torchani/resources/ani-1x_8x/train7/inputtrain.ipt
torchani/resources/ani-1x_8x/train7/inputtrain.ipt
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tests/test_data/inputtrain.ipt
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a2ba46e9
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@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train0/inputtrain.ipt
View file @
a2ba46e9
...
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@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
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@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train1/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train2/inputtrain.ipt
View file @
a2ba46e9
...
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@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train3/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train4/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train5/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train6/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1ccx_8x/train7/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -27,8 +27,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -55,8 +53,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -83,8 +79,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -111,8 +105,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train0/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train1/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train2/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train3/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train4/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train5/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train6/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
torchani/resources/ani-1x_8x/train7/inputtrain.ipt
View file @
a2ba46e9
...
...
@@ -26,8 +26,6 @@ network_setup {
nodes=160;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=128;
...
...
@@ -54,8 +52,6 @@ network_setup {
nodes=144;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -82,8 +78,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
@@ -110,8 +104,6 @@ network_setup {
nodes=128;
activation=9;
type=0;
l2norm=1;
l2valu=0.0001;
]
layer [
nodes=112;
...
...
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