qu-cmdwrapper 1.0.0
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- checksums.yaml +7 -0
- data/.gitignore +17 -0
- data/Gemfile +5 -0
- data/LICENSE.txt +22 -0
- data/README.md +32 -0
- data/Rakefile +1 -0
- data/lib/qu/cmdwrapper.rb +10 -0
- data/lib/qu/cmdwrapper/cmd.rb +109 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/32/faToTwoBit +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/32/ntdpal +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/32/ntthal +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/32/oligotm +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/32/primer3_core +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/32/twoBitToFa +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/64/faToTwoBit +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/64/ntdpal +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/64/ntthal +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/64/oligotm +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/64/primer3_core +0 -0
- data/lib/qu/cmdwrapper/ext_bin/linux/64/twoBitToFa +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/32/faToTwoBit +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/32/ntthal +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/32/oligotm +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/32/primer3_core +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/32/twoBitToFa +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/64/faToTwoBit +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/64/ntthal +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/64/oligotm +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/64/primer3_core +0 -0
- data/lib/qu/cmdwrapper/ext_bin/mac/64/twoBitToFa +0 -0
- data/lib/qu/cmdwrapper/primer3_config/dangle.dh +128 -0
- data/lib/qu/cmdwrapper/primer3_config/dangle.ds +128 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/dangle_i.dh +131 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/dangle_i.ds +131 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/loops_i.dh +34 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/loops_i.ds +31 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/stack_i.dh +257 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/stack_i.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/stackmm_i_mm.dh +257 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/stackmm_i_mm.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tetraloop_i.dh +79 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tetraloop_i.ds +81 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/triloop_i.dh +21 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/triloop_i.ds +18 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tstack2_i.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tstack2_i.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tstack_i.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tstack_i.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tstack_tm_inf_i.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/interpretations/tstack_tm_inf_i.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/loops.dh +30 -0
- data/lib/qu/cmdwrapper/primer3_config/loops.ds +30 -0
- data/lib/qu/cmdwrapper/primer3_config/stack.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/stack.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/stackmm.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/stackmm.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/tetraloop.dh +77 -0
- data/lib/qu/cmdwrapper/primer3_config/tetraloop.ds +77 -0
- data/lib/qu/cmdwrapper/primer3_config/triloop.dh +16 -0
- data/lib/qu/cmdwrapper/primer3_config/triloop.ds +16 -0
- data/lib/qu/cmdwrapper/primer3_config/tstack.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/tstack2.dh +256 -0
- data/lib/qu/cmdwrapper/primer3_config/tstack2.ds +256 -0
- data/lib/qu/cmdwrapper/primer3_config/tstack_tm_inf.ds +256 -0
- data/lib/qu/cmdwrapper/version.rb +5 -0
- data/qu-cmdwrapper.gemspec +24 -0
- metadata +137 -0
@@ -0,0 +1,256 @@
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1
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+
AA_AA inf
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2
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+
AA_AC inf
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3
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+
AA_AG inf
|
4
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+
AA_AT 12.9
|
5
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+
AA_CA inf
|
6
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+
AA_CC inf
|
7
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+
AA_CG inf
|
8
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+
AA_CT 20.2
|
9
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+
AA_GA inf
|
10
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+
AA_GC inf
|
11
|
+
AA_GG inf
|
12
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+
AA_GT 7.4
|
13
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+
AA_TA 1.7
|
14
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+
AA_TC 4.6
|
15
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+
AA_TG -2.3
|
16
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+
AA_TT inf
|
17
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+
AC_AA inf
|
18
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+
AC_AC inf
|
19
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+
AC_AG -9.8
|
20
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+
AC_AT inf
|
21
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+
AC_CA inf
|
22
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+
AC_CC inf
|
23
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+
AC_CG -3.8
|
24
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+
AC_CT inf
|
25
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+
AC_GA inf
|
26
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+
AC_GC inf
|
27
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+
AC_GG 3.2
|
28
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+
AC_GT inf
|
29
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+
AC_TA 14.6
|
30
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+
AC_TC -4.4
|
31
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+
AC_TG inf
|
32
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+
AC_TT 0.2
|
33
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+
AG_AA inf
|
34
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+
AG_AC -4.2
|
35
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+
AG_AG inf
|
36
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+
AG_AT inf
|
37
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+
AG_CA inf
|
38
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+
AG_CC 0.6
|
39
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+
AG_CG inf
|
40
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+
AG_CT inf
|
41
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+
AG_GA inf
|
42
|
+
AG_GC -13.2
|
43
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+
AG_GG inf
|
44
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+
AG_GT inf
|
45
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+
AG_TA -2.3
|
46
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+
AG_TC inf
|
47
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+
AG_TG -9.5
|
48
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+
AG_TT 0.9
|
49
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+
AT_AA 1.7
|
50
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+
AT_AC inf
|
51
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+
AT_AG inf
|
52
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+
AT_AT inf
|
53
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+
AT_CA 14.6
|
54
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+
AT_CC inf
|
55
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+
AT_CG inf
|
56
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+
AT_CT inf
|
57
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+
AT_GA -2.3
|
58
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+
AT_GC inf
|
59
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+
AT_GG inf
|
60
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+
AT_GT inf
|
61
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+
AT_TA inf
|
62
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+
AT_TC -6.2
|
63
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+
AT_TG -8.3
|
64
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+
AT_TT -10.8
|
65
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+
CA_AA inf
|
66
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+
CA_AC inf
|
67
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+
CA_AG inf
|
68
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+
CA_AT 8.0
|
69
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+
CA_CA inf
|
70
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+
CA_CC inf
|
71
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+
CA_CG inf
|
72
|
+
CA_CT 16.4
|
73
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+
CA_GA -4.2
|
74
|
+
CA_GC 3.7
|
75
|
+
CA_GG -2.3
|
76
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+
CA_GT inf
|
77
|
+
CA_TA inf
|
78
|
+
CA_TC inf
|
79
|
+
CA_TG inf
|
80
|
+
CA_TT 0.7
|
81
|
+
CC_AA inf
|
82
|
+
CC_AC inf
|
83
|
+
CC_AG 14.2
|
84
|
+
CC_AT inf
|
85
|
+
CC_CA inf
|
86
|
+
CC_CC inf
|
87
|
+
CC_CG 8.9
|
88
|
+
CC_CT inf
|
89
|
+
CC_GA -0.6
|
90
|
+
CC_GC -7.2
|
91
|
+
CC_GG -19.9
|
92
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+
CC_GT -4.5
|
93
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+
CC_TA inf
|
94
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+
CC_TC inf
|
95
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+
CC_TG 13.5
|
96
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+
CC_TT inf
|
97
|
+
CG_AA inf
|
98
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+
CG_AC 3.7
|
99
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+
CG_AG inf
|
100
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+
CG_AT inf
|
101
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+
CG_CA inf
|
102
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+
CG_CC -7.2
|
103
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+
CG_CG inf
|
104
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+
CG_CT inf
|
105
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+
CG_GA -13.2
|
106
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+
CG_GC inf
|
107
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+
CG_GG -15.3
|
108
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+
CG_GT -11.7
|
109
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+
CG_TA inf
|
110
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+
CG_TC -6.1
|
111
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+
CG_TG inf
|
112
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+
CG_TT inf
|
113
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+
CT_AA 4.6
|
114
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+
CT_AC inf
|
115
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+
CT_AG inf
|
116
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+
CT_AT inf
|
117
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+
CT_CA -4.4
|
118
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+
CT_CC inf
|
119
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+
CT_CG inf
|
120
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+
CT_CT inf
|
121
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+
CT_GA inf
|
122
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+
CT_GC -6.1
|
123
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+
CT_GG -8.0
|
124
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+
CT_GT -15.8
|
125
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+
CT_TA -6.2
|
126
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+
CT_TC inf
|
127
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+
CT_TG inf
|
128
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+
CT_TT inf
|
129
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+
GA_AA inf
|
130
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+
GA_AC inf
|
131
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+
GA_AG inf
|
132
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+
GA_AT 0.7
|
133
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+
GA_CA -9.8
|
134
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+
GA_CC 14.2
|
135
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+
GA_CG -1.0
|
136
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+
GA_CT inf
|
137
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+
GA_GA inf
|
138
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+
GA_GC inf
|
139
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+
GA_GG inf
|
140
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+
GA_GT 3.6
|
141
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+
GA_TA inf
|
142
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+
GA_TC inf
|
143
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+
GA_TG inf
|
144
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+
GA_TT -5.3
|
145
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+
GC_AA inf
|
146
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+
GC_AC inf
|
147
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+
GC_AG -1.0
|
148
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+
GC_AT inf
|
149
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+
GC_CA -3.8
|
150
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+
GC_CC 8.9
|
151
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+
GC_CG inf
|
152
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+
GC_CT 5.4
|
153
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+
GC_GA inf
|
154
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+
GC_GC inf
|
155
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+
GC_GG -15.8
|
156
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+
GC_GT inf
|
157
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+
GC_TA inf
|
158
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+
GC_TC inf
|
159
|
+
GC_TG -12.3
|
160
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+
GC_TT inf
|
161
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+
GG_AA inf
|
162
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+
GG_AC -2.3
|
163
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+
GG_AG inf
|
164
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+
GG_AT inf
|
165
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+
GG_CA 3.2
|
166
|
+
GG_CC -19.9
|
167
|
+
GG_CG -15.8
|
168
|
+
GG_CT 10.4
|
169
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+
GG_GA inf
|
170
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+
GG_GC -15.3
|
171
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+
GG_GG inf
|
172
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+
GG_GT inf
|
173
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+
GG_TA inf
|
174
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+
GG_TC 80
|
175
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+
GG_TG inf
|
176
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+
GG_TT 16.3
|
177
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+
GT_AA 23
|
178
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+
GT_AC inf
|
179
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+
GT_AG inf
|
180
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+
GT_AT inf
|
181
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+
GT_CA inf
|
182
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+
GT_CC 13.5
|
183
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+
GT_CG -12.3
|
184
|
+
GT_CT -8.4
|
185
|
+
GT_GA -9.5
|
186
|
+
GT_GC inf
|
187
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+
GT_GG inf
|
188
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+
GT_GT inf
|
189
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+
GT_TA -8.3
|
190
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+
GT_TC inf
|
191
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+
GT_TG 9.5
|
192
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+
GT_TT inf
|
193
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+
TA_AA 12.9
|
194
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+
TA_AC 8.0
|
195
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+
TA_AG 0.7
|
196
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+
TA_AT inf
|
197
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+
TA_CA inf
|
198
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+
TA_CC inf
|
199
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+
TA_CG inf
|
200
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+
TA_CT 0.7
|
201
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+
TA_GA inf
|
202
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+
TA_GC inf
|
203
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+
TA_GG inf
|
204
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+
TA_GT -1.7
|
205
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+
TA_TA inf
|
206
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+
TA_TC inf
|
207
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+
TA_TG inf
|
208
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+
TA_TT -1.5
|
209
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+
TC_AA 20.2
|
210
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+
TC_AC 16.4
|
211
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+
TC_AG inf
|
212
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+
TC_AT 0.7
|
213
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+
TC_CA inf
|
214
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+
TC_CC inf
|
215
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+
TC_CG 5.4
|
216
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+
TC_CT inf
|
217
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+
TC_GA inf
|
218
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+
TC_GC inf
|
219
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+
TC_GG 10.4
|
220
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+
TC_GT inf
|
221
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+
TC_TA inf
|
222
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+
TC_TC inf
|
223
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+
TC_TG -8.4
|
224
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+
TC_TT inf
|
225
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+
TG_AA 7.4
|
226
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+
TG_AC inf
|
227
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+
TG_AG 3.6
|
228
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TG_AT -1.7
|
229
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+
TG_CA inf
|
230
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+
TG_CC -4.5
|
231
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+
TG_CG inf
|
232
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+
TG_CT inf
|
233
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+
TG_GA inf
|
234
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+
TG_GC -11.7
|
235
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+
TG_GG inf
|
236
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+
TG_GT -6.2
|
237
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+
TG_TA inf
|
238
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+
TG_TC -15.8
|
239
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TG_TG inf
|
240
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TG_TT inf
|
241
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TT_AA inf
|
242
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TT_AC -7
|
243
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TT_AG -5.3
|
244
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TT_AT -1.5
|
245
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+
TT_CA 0.2
|
246
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+
TT_CC inf
|
247
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+
TT_CG inf
|
248
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+
TT_CT inf
|
249
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+
TT_GA 0.9
|
250
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+
TT_GC inf
|
251
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+
TT_GG 16.3
|
252
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+
TT_GT inf
|
253
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+
TT_TA -10.8
|
254
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+
TT_TC inf
|
255
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+
TT_TG inf
|
256
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+
TT_TT inf
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@@ -0,0 +1,79 @@
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1
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/* tetraloop bonuses for GNRA and GNAB kcal/mol*(-10) */
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2
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3
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AAAAAT -5
|
4
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+
AAAACT -7
|
5
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+
AAACAT -10
|
6
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+
ACTTGT 0
|
7
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+
AGAAAT 11
|
8
|
+
AGAGAT 11
|
9
|
+
AGATAT 15
|
10
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+
AGCAAT 16
|
11
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+
AGCGAT 11
|
12
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+
AGCTTT -2
|
13
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+
AGGAAT 11
|
14
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+
AGGGAT 11
|
15
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+
AGGGGT -5
|
16
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+
AGTAAT 16
|
17
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+
AGTGAT 11
|
18
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+
AGTTCT -8
|
19
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+
ATTCGT 2
|
20
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+
ATTTGT 0
|
21
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+
ATTTTT 5
|
22
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+
CAAAAG -5
|
23
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+
CAAACG -7
|
24
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+
CAACAG -10
|
25
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+
CAACCG 0
|
26
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+
CCTTGG 0
|
27
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+
CGAAAG 11
|
28
|
+
CGAGAG 11
|
29
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+
CGATAG 15
|
30
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+
CGCAAG 16
|
31
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+
CGCGAG 11
|
32
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+
CGCTTG -2
|
33
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+
CGGAAG 11
|
34
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+
CGGGAG 10
|
35
|
+
CGGGGG -5
|
36
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+
CGTAAG 16
|
37
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+
CGTGAG 11
|
38
|
+
CGTTCG -8
|
39
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+
CTTCGG 2
|
40
|
+
CTTTGG 0
|
41
|
+
CTTTTG 5
|
42
|
+
GAAAAC -5
|
43
|
+
GAAACC -7
|
44
|
+
GAACAC -10
|
45
|
+
GCTTGC 0
|
46
|
+
GGAAAC 11
|
47
|
+
GGAGAC 11
|
48
|
+
GGATAC 16
|
49
|
+
GGCAAC 16
|
50
|
+
GGCGAC 11
|
51
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+
GGCTTC -2
|
52
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+
GGGAAC 11
|
53
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+
GGGGAC 11
|
54
|
+
GGGGGC -5
|
55
|
+
GGTAAC 16
|
56
|
+
GGTGAC 11
|
57
|
+
GGTTCC -8
|
58
|
+
GTTCGC 2
|
59
|
+
GTTTGC 0
|
60
|
+
GTTTTC 5
|
61
|
+
TAAAAA -5
|
62
|
+
TAAACA -7
|
63
|
+
TAACAA -10
|
64
|
+
TCTTGA 0
|
65
|
+
TGAAAA 11
|
66
|
+
TGAGAA 11
|
67
|
+
TGATAA 16
|
68
|
+
TGCAAA 16
|
69
|
+
TGCGAA 11
|
70
|
+
TGCTTA -2
|
71
|
+
TGGAAA 11
|
72
|
+
TGGGAA 11
|
73
|
+
TGGGGA -5
|
74
|
+
TGTAAA 16
|
75
|
+
TGTGAA 11
|
76
|
+
TGTTCA -8
|
77
|
+
TTTCGA 2
|
78
|
+
TTTTGA 0
|
79
|
+
TTTTTA 5
|
@@ -0,0 +1,81 @@
|
|
1
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+
/*
|
2
|
+
VIIDE
|
3
|
+
*/
|
4
|
+
|
5
|
+
AAAAAT 6.5
|
6
|
+
AAAACT -16.1
|
7
|
+
AAACAT -16.1
|
8
|
+
ACTTGT -41.9
|
9
|
+
AGAAAT -16.1
|
10
|
+
AGAGAT -16.1
|
11
|
+
AGATAT -16.1
|
12
|
+
AGCAAT -16.1
|
13
|
+
AGCGAT -16.1
|
14
|
+
AGCTTT -16.1
|
15
|
+
AGGAAT -16.1
|
16
|
+
AGGGAT -16.1
|
17
|
+
AGGGGT -6.4
|
18
|
+
AGTAAT -16.1
|
19
|
+
AGTGAT -16.1
|
20
|
+
AGTTCT -16.1
|
21
|
+
ATTCGT -16.1
|
22
|
+
ATTTGT -16.1
|
23
|
+
ATTTTT -16.1
|
24
|
+
CAAAAG 12.9
|
25
|
+
CAAACG 0
|
26
|
+
CAACAG 0
|
27
|
+
CAACCG 0
|
28
|
+
CCTTGG -25.7
|
29
|
+
CGAAAG 0
|
30
|
+
CGAGAG 0
|
31
|
+
CGATAG 0
|
32
|
+
CGCAAG 0
|
33
|
+
CGCGAG 0
|
34
|
+
CGCTTG 0
|
35
|
+
CGGAAG 0
|
36
|
+
CGGGAG 0
|
37
|
+
CGGGGG 9.7
|
38
|
+
CGTAAG 0
|
39
|
+
CGTGAG 0
|
40
|
+
CGTTCG 0
|
41
|
+
CTTCGG 0
|
42
|
+
CTTTGG 0
|
43
|
+
CTTTTG 0
|
44
|
+
GAAAAC 32.3
|
45
|
+
GAAACC 0
|
46
|
+
GAACAC 0
|
47
|
+
GCTTGC -25.7
|
48
|
+
GGAAAC 0
|
49
|
+
GGAGAC 0
|
50
|
+
GGATAC 0
|
51
|
+
GGCAAC 0
|
52
|
+
GGCGAC 0
|
53
|
+
GGCTTC 0
|
54
|
+
GGGAAC 0
|
55
|
+
GGGGAC 0
|
56
|
+
GGGGGC 9.7
|
57
|
+
GGTAAC 0
|
58
|
+
GGTGAC 0
|
59
|
+
GGTTCC 0
|
60
|
+
GTTCGC 0
|
61
|
+
GTTTGC 0
|
62
|
+
GTTTTC 0
|
63
|
+
TAAAAA -3.2
|
64
|
+
TAAACA -16.1
|
65
|
+
TAACAA -16.1
|
66
|
+
TCTTGA -41.9
|
67
|
+
TGAAAA -16.1
|
68
|
+
TGAGAA -16.1
|
69
|
+
TGATAA -16.1
|
70
|
+
TGCAAA -16.1
|
71
|
+
TGCGAA -16.1
|
72
|
+
TGCTTA -16.1
|
73
|
+
TGGAAA -16.1
|
74
|
+
TGGGAA -16.1
|
75
|
+
TGGGGA -6.4
|
76
|
+
TGTAAA -16.1
|
77
|
+
TGTGAA -16.1
|
78
|
+
TGTTCA -16.1
|
79
|
+
TTTCGA -16.1
|
80
|
+
TTTTGA -16.1
|
81
|
+
TTTTTA -16.1
|
@@ -0,0 +1,21 @@
|
|
1
|
+
|
2
|
+
/* triloop bonus*/
|
3
|
+
|
4
|
+
/* Enthalpy Hairpin loop */
|
5
|
+
|
6
|
+
AGAAT 15
|
7
|
+
AGCAT 15
|
8
|
+
AGGAT 15
|
9
|
+
AGTAT 15
|
10
|
+
CGAAG 20
|
11
|
+
CGCAG 20
|
12
|
+
CGGAG 20
|
13
|
+
CGTAG 20
|
14
|
+
GGAAC 20
|
15
|
+
GGCAC 20
|
16
|
+
GGGAC 20
|
17
|
+
GGTAC 20
|
18
|
+
TGAAA 15
|
19
|
+
TGCAA 15
|
20
|
+
TGGAA 15
|
21
|
+
TGTAA 15
|