Thursday, July 04 2024 20:55:30
UNRES
1.03s| Exit Value | 1 |
|---|
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CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
2
2
JESTEM
JESTEM
JESTEM
JESTEM
JESTEM
JESTEM
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
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
Call Read_Bridge.
ns= 0
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
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
ns= 0
ATU 3
Calling CHECK_ECARTINT 1.000D-07
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Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 0.93522906303405762 sec
Processor 1 wait times for respective orders order[ 0 ] 4.3654441833496094E-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 ] 6.9529958944047452E-310 order[ 7 ] 4.2641162872314453E-003 order[ 8 ] 6.9529958944047452E-310 order[ 9 ] 2.3421671181021744E-310 order[ 10 ] 6.0134700169990685E-154
Processor 0 BROADCAST time 1.6608238220214844E-003 REDUCE time 1.7609357833862305E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 6.6761970520019531E-003 BARRIER grad 1.9073486328125000E-006
CG processor 0 is finishing work.
Largest abs(1-numerical/analytical)= 23.4507
Sorted:
1 -4.41567E+00
2 -1.84414E+00
3 -1.56225E+00
4 5.96651E-01
5 9.24084E-01
6 9.52158E-01
7 9.64585E-01
8 9.90281E-01
9 9.99537E-01
10 9.99625E-01
11 9.99768E-01
12 9.99886E-01
13 9.99904E-01
14 9.99910E-01
15 9.99916E-01
16 9.99917E-01
17 9.99926E-01
18 9.99932E-01
19 9.99935E-01
20 9.99937E-01
21 9.99938E-01
22 9.99941E-01
23 9.99946E-01
24 9.99947E-01
25 9.99952E-01
26 9.99953E-01
27 9.99958E-01
28 9.99958E-01
29 9.99960E-01
30 9.99961E-01
31 9.99962E-01
32 9.99962E-01
33 9.99967E-01
34 9.99968E-01
35 9.99969E-01
36 9.99970E-01
37 9.99970E-01
38 9.99973E-01
39 9.99974E-01
40 9.99974E-01
41 9.99974E-01
42 9.99975E-01
43 9.99976E-01
44 9.99977E-01
45 9.99979E-01
46 9.99980E-01
47 9.99982E-01
48 9.99983E-01
49 9.99983E-01
50 9.99985E-01
51 9.99985E-01
52 9.99985E-01
53 9.99985E-01
54 9.99986E-01
55 9.99987E-01
56 9.99988E-01
57 9.99988E-01
58 9.99988E-01
59 9.99989E-01
60 9.99989E-01
61 9.99991E-01
62 9.99991E-01
63 9.99992E-01
64 9.99992E-01
65 9.99992E-01
66 9.99992E-01
67 9.99992E-01
68 9.99993E-01
69 9.99993E-01
70 9.99993E-01
71 9.99993E-01
72 9.99993E-01
73 9.99993E-01
74 9.99994E-01
75 9.99994E-01
76 9.99994E-01
77 9.99994E-01
78 9.99994E-01
79 9.99995E-01
80 9.99995E-01
81 9.99995E-01
82 9.99995E-01
83 9.99996E-01
84 9.99996E-01
85 9.99996E-01
86 9.99996E-01
87 9.99997E-01
88 9.99997E-01
89 9.99997E-01
90 9.99997E-01
91 9.99997E-01
92 9.99997E-01
93 9.99997E-01
94 9.99998E-01
95 9.99998E-01
96 9.99998E-01
97 9.99998E-01
98 9.99998E-01
99 9.99998E-01
100 9.99998E-01
101 9.99998E-01
102 9.99998E-01
103 9.99998E-01
104 9.99998E-01
105 9.99999E-01
106 9.99999E-01
107 9.99999E-01
108 9.99999E-01
109 9.99999E-01
110 9.99999E-01
111 9.99999E-01
112 9.99999E-01
113 9.99999E-01
114 9.99999E-01
115 9.99999E-01
116 9.99999E-01
117 9.99999E-01
118 9.99999E-01
119 9.99999E-01
120 9.99999E-01
121 9.99999E-01
122 9.99999E-01
123 9.99999E-01
124 9.99999E-01
125 9.99999E-01
126 9.99999E-01
127 9.99999E-01
128 9.99999E-01
129 9.99999E-01
130 1.00000E+00
131 1.00000E+00
132 1.00000E+00
133 1.00000E+00
134 1.00000E+00
135 1.00000E+00
136 1.00000E+00
137 1.00000E+00
138 1.00000E+00
139 1.00000E+00
140 1.00000E+00
141 1.00000E+00
142 1.00000E+00
143 1.00000E+00
144 1.00000E+00
145 1.00000E+00
146 1.00000E+00
147 1.00000E+00
148 1.00000E+00
149 1.00000E+00
150 1.00000E+00
151 1.00000E+00
152 1.00000E+00
153 1.00000E+00
154 1.00000E+00
155 1.00000E+00
156 1.00000E+00
157 1.00000E+00
158 1.00000E+00
159 1.00000E+00
160 1.00000E+00
161 1.00000E+00
162 1.00000E+00
163 1.00000E+00
164 1.00000E+00
165 1.00000E+00
166 1.00000E+00
167 1.00000E+00
168 1.00000E+00
169 1.00000E+00
170 1.00000E+00
171 1.00000E+00
172 1.00000E+00
173 1.00000E+00
174 1.00000E+00
175 1.00000E+00
176 1.00000E+00
177 1.00000E+00
178 1.00000E+00
179 1.00000E+00
180 1.00000E+00
181 1.00000E+00
182 1.00000E+00
183 1.00000E+00
184 1.00000E+00
185 1.00000E+00
186 1.00000E+00
187 1.00000E+00
188 1.00000E+00
189 1.00000E+00
190 1.00000E+00
191 1.00000E+00
192 1.00000E+00
193 1.00000E+00
194 1.00000E+00
195 1.00000E+00
196 1.00000E+00
197 1.00000E+00
198 1.00000E+00
199 1.00000E+00
200 1.00000E+00
201 1.00000E+00
202 1.00000E+00
203 1.00000E+00
204 1.00000E+00
205 1.00000E+00
206 1.00000E+00
207 1.00001E+00
208 1.00001E+00
209 1.00001E+00
210 1.00001E+00
211 1.00001E+00
212 1.00001E+00
213 1.00001E+00
214 1.00001E+00
215 1.00001E+00
216 1.00001E+00
217 1.00001E+00
218 1.00001E+00
219 1.00001E+00
220 1.00001E+00
221 1.00001E+00
222 1.00001E+00
223 1.00001E+00
224 1.00001E+00
225 1.00001E+00
226 1.00002E+00
227 1.00002E+00
228 1.00002E+00
229 1.00002E+00
230 1.00002E+00
231 1.00002E+00
232 1.00002E+00
233 1.00002E+00
234 1.00002E+00
235 1.00002E+00
236 1.00002E+00
237 1.00002E+00
238 1.00002E+00
239 1.00002E+00
240 1.00002E+00
241 1.00002E+00
242 1.00002E+00
243 1.00003E+00
244 1.00003E+00
245 1.00003E+00
246 1.00003E+00
247 1.00003E+00
248 1.00003E+00
249 1.00003E+00
250 1.00004E+00
251 1.00004E+00
252 1.00004E+00
253 1.00004E+00
254 1.00004E+00
255 1.00005E+00
256 1.00005E+00
257 1.00005E+00
258 1.00005E+00
259 1.00006E+00
260 1.00006E+00
261 1.00006E+00
262 1.00007E+00
263 1.00007E+00
264 1.00009E+00
265 1.00009E+00
266 1.00009E+00
267 1.00011E+00
268 1.00012E+00
269 1.00012E+00
270 1.00014E+00
271 1.00015E+00
272 1.00098E+00
273 1.00129E+00
274 1.00191E+00
275 1.78313E+00
276 3.28463E+00
277 4.73355E+00
278 7.34502E+00
279 2.44507E+01
ERROR largest abs(1-numerical/analytical) 23.4507000000
greater than 0.025
