| A reliable and efficient first principles-based method for predicting pKa values. 4. organic bases | |
| Zhang, Shuming | |
| 2012 | |
| 卷号 | 33期号:31页码:2469-2482 |
| 关键词 | pKa prediction organic bases COSMO solvation model ab initio density functional theory |
| ISSN号 | 0192-8651 |
| DOI | 10.1002/jcc.23068 |
| URL标识 | 查看原文 |
| 收录类别 | SCIE |
| 内容类型 | 期刊论文 |
| URI标识 | http://www.corc.org.cn/handle/1471x/6722253 |
| 专题 | 中国医学科学院 北京协和医学院 |
| 推荐引用方式 GB/T 7714 | Zhang, Shuming. A reliable and efficient first principles-based method for predicting pKa values. 4. organic bases[J],2012,33(31):2469-2482. |
| APA | Zhang, Shuming.(2012).A reliable and efficient first principles-based method for predicting pKa values. 4. organic bases.,33(31),2469-2482. |
| MLA | Zhang, Shuming."A reliable and efficient first principles-based method for predicting pKa values. 4. organic bases".33.31(2012):2469-2482. |
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