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sumwindy金虫 (正式写手)
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[交流]
求助C级和G级错误
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准备投Acta E。 在线检查，报告如下： Alert level B PLAT420_ALERT_2_B D-H Without Acceptor O5 - H5B ... ? -------------------------------------------------------------------------------- Alert level C PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) La1 -- O1 .. 5.79 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) La1 -- O5 .. 5.69 su -------------------------------------------------------------------------------- Alert level G ABSTM02_ALERT_3_G When printed, the submitted absorption T values will be replaced by the scaled T values. Since the ratio of scaled T's is identical to the ratio of reported T values, the scaling does not imply a change to the absorption corrections used in the study. Ratio of Tmax expected/reported 0.365 Tmax scaled 0.365 Tmin scaled 0.239 PLAT062_ALERT_4_G Rescale T(min) & T(max) by ..................... 0.37 PLAT199_ALERT_1_G Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_G Check the Reported _diffrn_ambient_temperature . 293 K PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 32 LA1 -O2 -C1 -O1 27.80 1.20 8.765 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 33 LA1 -O2 -C1 -C2 -150.20 0.90 8.765 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 63 N2 -C4 -C5 -LA1 129.00 1.00 1.555 1.555 1.555 7.565 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 64 C3 -C4 -C5 -LA1 -49.80 1.20 1.555 1.555 1.555 7.565 PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.35 Ratio -------------------------------------------------------------------------------- 0 ALERT level A = In general: serious problem 1 ALERT level B = Potentially serious problem 2 ALERT level C = Check and explain 9 ALERT level G = General alerts; check 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 3 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 6 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check 请教有经验的虫子，这些错误，需要纠正吗？该怎么纠正？ [ Last edited by sumwindy on 2009-4-17 at 08:19 ] |
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felix1981
木虫 (小有名气)
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warlen(金币+1,VIP+0):3q 4-17 11:32
sumwindy(金币+5,VIP+0):thanks 4-20 08:35
warlen(金币+1,VIP+0):3q 4-17 11:32
sumwindy(金币+5,VIP+0):thanks 4-20 08:35
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B级错误重新通过残峰加氢试试，看能否消除 两个C级错误不影响投稿 G级错误，需要核实一下这几个键是否真实存在，否则按其要求删除： PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 32 LA1 -O2 -C1 -O1 27.80 1.20 8.765 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 33 LA1 -O2 -C1 -C2 -150.20 0.90 8.765 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 63 N2 -C4 -C5 -LA1 129.00 1.00 1.555 1.555 1.555 7.565 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 64 C3 -C4 -C5 -LA1 -49.80 1.20 1.555 1.555 1.555 7.565 |
2楼2009-04-17 08:21:26
sumwindy
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3楼2009-04-17 08:32:01
zhaoyangqufu
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4楼2009-04-17 08:51:00