Friday, September 20 2024 00:44:33
UNRES
0.50s| Exit Value | 1 |
|---|
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Show Failing/Passing Graph
CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
2
2
indpdb= 16 pdbref= T
0.0000000000000000 0.0000000000000000
45 46 47
1.9750000000000014 -2.0169999999999995
45 46 47
-0.87200000000000000 -3.2160000000000002
45 46 47
3.1690000000000000 0.43400000000000016
0.0000000000000000 0.0000000000000000
45 46 47
0.0000000000000000 0.0000000000000000
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
1.9750000000000014 -2.0169999999999995
45 46 47
-0.87200000000000000 -3.2160000000000002
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
45 46 47
3.1690000000000000 0.43400000000000016
0.0000000000000000 0.0000000000000000
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
ns= 0
Call Read_Bridge.
ns= 0
ATU 3
Calling CHECK_ECARTINT 1.000D-04
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Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 0.44352483749389648 sec
Processor 1 wait times for respective orders order[ 0 ] 2.5629997253417969E-004 order[ 1 ] 6.0134700169990685E-154 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 6.0134700169990685E-154 order[ 6 ] 6.9525863468559137E-310 order[ 7 ] 2.0020008087158203E-003 order[ 8 ] 6.9525863468559137E-310 order[ 9 ] 2.3339594362351267E-310 order[ 10 ] 6.0134700169990685E-154
Processor 0 BROADCAST time 1.3327598571777344E-003 REDUCE time 1.2302398681640625E-003 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 2.6283264160156250E-002 BARRIER grad 2.8610229492187500E-006
CG processor 0 is finishing work.
Largest abs(1-numerical/analytical)= 1
Sorted:
1 0.00000E+00
2 -0.00000E+00
3 -0.00000E+00
4 0.00000E+00
5 -0.00000E+00
6 0.00000E+00
7 -0.00000E+00
8 -0.00000E+00
9 -0.00000E+00
10 0.00000E+00
11 -0.00000E+00
12 -0.00000E+00
13 -0.00000E+00
14 -0.00000E+00
15 -0.00000E+00
16 -0.00000E+00
17 -0.00000E+00
18 0.00000E+00
19 0.00000E+00
20 0.00000E+00
21 0.00000E+00
22 0.00000E+00
23 0.00000E+00
24 -0.00000E+00
25 -0.00000E+00
26 -0.00000E+00
27 0.00000E+00
28 0.00000E+00
29 -0.00000E+00
30 -0.00000E+00
31 -0.00000E+00
32 -0.00000E+00
33 -0.00000E+00
34 -0.00000E+00
35 -0.00000E+00
36 0.00000E+00
37 -0.00000E+00
38 -0.00000E+00
39 -0.00000E+00
40 -0.00000E+00
41 -0.00000E+00
42 0.00000E+00
43 0.00000E+00
44 0.00000E+00
45 -0.00000E+00
46 -0.00000E+00
47 0.00000E+00
48 0.00000E+00
49 0.00000E+00
50 0.00000E+00
51 -0.00000E+00
52 -0.00000E+00
53 -0.00000E+00
54 -0.00000E+00
55 0.00000E+00
56 0.00000E+00
57 -0.00000E+00
58 -0.00000E+00
59 0.00000E+00
60 -0.00000E+00
61 0.00000E+00
62 -0.00000E+00
63 -0.00000E+00
64 -0.00000E+00
65 0.00000E+00
66 0.00000E+00
67 -0.00000E+00
68 0.00000E+00
69 -0.00000E+00
70 -0.00000E+00
71 -0.00000E+00
72 -0.00000E+00
73 0.00000E+00
74 -0.00000E+00
75 0.00000E+00
76 0.00000E+00
77 -0.00000E+00
78 0.00000E+00
79 -0.00000E+00
80 -0.00000E+00
81 -0.00000E+00
82 -0.00000E+00
83 0.00000E+00
84 -0.00000E+00
85 -0.00000E+00
86 0.00000E+00
87 0.00000E+00
88 0.00000E+00
89 0.00000E+00
90 0.00000E+00
91 0.00000E+00
92 0.00000E+00
93 -0.00000E+00
94 -0.00000E+00
95 0.00000E+00
96 -0.00000E+00
97 -0.00000E+00
98 -0.00000E+00
99 0.00000E+00
100 0.00000E+00
101 -0.00000E+00
102 0.00000E+00
103 0.00000E+00
104 0.00000E+00
105 0.00000E+00
106 -0.00000E+00
107 -0.00000E+00
108 -0.00000E+00
109 0.00000E+00
110 0.00000E+00
111 0.00000E+00
112 0.00000E+00
113 -0.00000E+00
114 0.00000E+00
115 0.00000E+00
116 -0.00000E+00
117 -0.00000E+00
118 -0.00000E+00
119 0.00000E+00
120 -0.00000E+00
121 -0.00000E+00
122 -0.00000E+00
123 -0.00000E+00
124 -0.00000E+00
125 -0.00000E+00
126 0.00000E+00
127 0.00000E+00
128 -0.00000E+00
129 0.00000E+00
130 0.00000E+00
131 0.00000E+00
132 -0.00000E+00
133 -0.00000E+00
134 -0.00000E+00
135 -0.00000E+00
136 -0.00000E+00
137 -0.00000E+00
138 -0.00000E+00
139 -0.00000E+00
140 0.00000E+00
141 -0.00000E+00
142 -0.00000E+00
143 -0.00000E+00
144 -0.00000E+00
145 0.00000E+00
146 0.00000E+00
147 -0.00000E+00
148 0.00000E+00
149 0.00000E+00
150 0.00000E+00
151 0.00000E+00
152 0.00000E+00
153 -0.00000E+00
154 -0.00000E+00
155 0.00000E+00
156 -0.00000E+00
157 0.00000E+00
158 -0.00000E+00
159 0.00000E+00
160 -0.00000E+00
161 -0.00000E+00
162 -0.00000E+00
163 -0.00000E+00
164 -0.00000E+00
165 -0.00000E+00
166 0.00000E+00
167 -0.00000E+00
168 -0.00000E+00
169 0.00000E+00
170 -0.00000E+00
171 -0.00000E+00
172 -0.00000E+00
173 -0.00000E+00
174 0.00000E+00
175 0.00000E+00
176 -0.00000E+00
177 -0.00000E+00
178 0.00000E+00
179 0.00000E+00
180 -0.00000E+00
181 0.00000E+00
182 -0.00000E+00
183 0.00000E+00
184 -0.00000E+00
185 -0.00000E+00
186 0.00000E+00
187 -0.00000E+00
188 0.00000E+00
189 -0.00000E+00
190 0.00000E+00
191 0.00000E+00
192 0.00000E+00
193 0.00000E+00
194 0.00000E+00
195 -0.00000E+00
196 -0.00000E+00
197 0.00000E+00
198 0.00000E+00
199 0.00000E+00
200 0.00000E+00
201 -0.00000E+00
202 0.00000E+00
203 -0.00000E+00
204 0.00000E+00
205 -0.00000E+00
206 0.00000E+00
207 0.00000E+00
208 0.00000E+00
209 -0.00000E+00
210 0.00000E+00
211 -0.00000E+00
212 0.00000E+00
213 -0.00000E+00
214 -0.00000E+00
215 0.00000E+00
216 0.00000E+00
217 0.00000E+00
218 0.00000E+00
219 -0.00000E+00
220 -0.00000E+00
221 0.00000E+00
222 0.00000E+00
223 0.00000E+00
224 0.00000E+00
225 0.00000E+00
226 0.00000E+00
227 0.00000E+00
228 0.00000E+00
229 0.00000E+00
230 0.00000E+00
231 0.00000E+00
232 -0.00000E+00
233 0.00000E+00
234 0.00000E+00
235 -0.00000E+00
236 -0.00000E+00
237 0.00000E+00
238 -0.00000E+00
239 0.00000E+00
240 0.00000E+00
241 0.00000E+00
242 -0.00000E+00
243 0.00000E+00
244 0.00000E+00
245 -0.00000E+00
246 -0.00000E+00
247 0.00000E+00
248 0.00000E+00
249 -0.00000E+00
250 -0.00000E+00
251 0.00000E+00
252 0.00000E+00
253 0.00000E+00
254 0.00000E+00
255 0.00000E+00
256 0.00000E+00
257 0.00000E+00
258 -0.00000E+00
259 -0.00000E+00
260 0.00000E+00
261 -0.00000E+00
262 0.00000E+00
263 0.00000E+00
264 0.00000E+00
265 -0.00000E+00
266 0.00000E+00
267 -0.00000E+00
268 0.00000E+00
269 0.00000E+00
270 -0.00000E+00
271 0.00000E+00
272 0.00000E+00
273 -0.00000E+00
274 0.00000E+00
275 -0.00000E+00
276 0.00000E+00
277 -0.00000E+00
278 -0.00000E+00
279 0.00000E+00
ERROR largest abs(1-numerical/analytical) 1.0000000000
greater than 0.025
