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十八的貓銀蟲(chóng) (正式寫(xiě)手)
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[求助]
超級(jí)多的A類(lèi)警告，關(guān)于ADP類(lèi)問(wèn)題
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求助：：checkcif之后有超級(jí)多的ADP類(lèi)問(wèn)題要怎么解決啊 用isor或者delu也限制不了 SHFSU01_ALERT_2_A The absolute value of parameter shift to su ratio > 0.20 Absolute value of the parameter shift to su ratio given 2.114 Additional refinement cycles may be required. PLAT080_ALERT_2_A Maximum Shift/Error ............................ 2.11 Why ? PLAT203_ALERT_2_A Negative Isotropic ADP for P00D ........... -0.001 Report PLAT211_ALERT_2_A ADP of Atom P00D is N.P.D. or (nearly) 2D . Please Check And 26 other PLAT211 Alerts Less ... PLAT211_ALERT_2_A ADP of Atom O1 is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00E is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00F is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00H is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00I is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00J is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00K is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00L is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00M is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00N is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00O is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00P is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00Q is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00R is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00V is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00W is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00X is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O00Y is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O011 is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O012 is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O013 is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O014 is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O016 is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O01B is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O01D is N.P.D. or (nearly) 2D . Please Check PLAT211_ALERT_2_A ADP of Atom O01G is N.P.D. or (nearly) 2D . Please Check PLAT213_ALERT_2_A Atom O01E has ADP max/min Ratio ..... 8.6 prolat PLAT214_ALERT_2_A Atom N01Q (Anion/Solvent) ADP max/min Ratio 7.1 prolat@jackdeng@lich666 |
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