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yuanf2011

银虫 (正式写手)

[求助] CIF文件中A类错误

请教各位大侠:PLAT602_ALERT_2_A VERY LARGE Solvent Accessible VOID(S) in Structure怎么消除呢,还有这个ccdc号怎么申请呢?谢谢大侠!!!!
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huahua1216

至尊木虫 (文坛精英)

【答案】应助回帖

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感谢参与,应助指数 +1
lijunjie84: 金币+1 2012-05-30 11:23:39
lijunjie84: , 感谢应助!!! 2012-05-30 11:23:47
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4楼: Originally posted by chilajiao at 2012-05-29 07:49:31
请问cf老师,这个 squeeze 指令是什么意思呢?...

platon下面的一个命令 一般处理大孔结构中无序的溶剂分子用到的
5楼2012-05-29 08:23:06
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sdujjt

木虫 (正式写手)

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感谢参与,应助指数 +1
linhua0402313: , 恩,很详细,希望对楼主有帮助 2012-05-28 18:54:06
无法消除,解释。ccdc有个邮箱,或者登陆网站、http://www.ccdc.cam.ac.uk/
生命像一条大河
2楼2012-05-28 18:37:44
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cfocus20

至尊木虫 (职业作家)

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PLAT602_ALERT_2_A VERY LARGE Solvent Accessible VOID(S) in Structure

??_?J???w?????r?Пo???squeeze???, ????Е??a??filename.sqz
???@???n???e??????????cif?n????????, cif check?r????????@?????}!
Smart_work_and_beautiful_life!
3楼2012-05-29 02:26:46
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chilajiao

金虫 (知名作家)

深海家族No.1

优秀版主

???????:
3?: Originally posted by cfocus20 at 2012-05-29 02:26:46
PLAT602_ALERT_2_A VERY LARGE Solvent Accessible VOID(S) in Structure

??_?J???w?????r?Пo???squeeze???, ????Е??a??filename.sqz
???@???n???e??????????cif?n????????, cif check?r????????@???? ...

????cf???????? squeeze ?????????????
只爱乐儿
4楼2012-05-29 07:49:31
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