数据库索引.ppt

,单击此处编辑母版标题样式,单击此处编辑母版文本样式,第二级,第三级,第四级,第五级,*,.,*,数据库索引,北京航空航天大学材料科学与工程学院,杨光,1,.,NIMC有机物谱图库,SDBS:NIMC有机物谱图库，日本,免费,riodb01.ibase.aist.go.jp/sdbs/cgi-bin/cre_index.cgi?lang=eng,2,.,FDM的参考谱图库,FDM的参考谱图库(主要是红外谱FTIR),部分免费,Online,Galactic,Spectra Online,Galactic(红外谱图),FTIR is a unique web site dedicated to providing analytical chemists with on-line access to high quality FTIR and Raman spectral libraries.,Spectral Viewer(FT-IR、FT-NMR谱图库光盘),(包括MSDS、5000张红外谱图),免费,www.chemexper.be/,8,.,NMR谱图数据库及NMR谱图预测,nmrdb.org(NMR谱图数据库及NMR谱图预测),免费,www.nmrdb.org/,9,.,NMRShiftDB,NMR谱图数据库和NMR谱图预测,免费,nmrshiftdb.cubic.uni-koeln.de/nmrshiftdb,10,.,FTNMR Spectra in NUTSTM Format,The FTNMR FID archive(see below)lists a number of 13C,1H,and APT free induction decay files in Nuts format(a Windows NMR off-line data processing program).Most of these files are also available on another page of the Archive in Felix for Windows format(another off-line NMR data processing program).,rainier.chem.plu.edu/nutsform.html,11,.,ACD/I-Lab,ACD/I-Lab(NMR谱预测、物性预测、化合物系统命名自动生成),ACD/I-Lab is an Internet-based service for instant access to chemical databases and property predictions programs.With I-Lab access,you can obtain NMR spectra,get systematic chemical names and predict properties such as pKa or LogP for their chemical structures from both your Internet browser and from inside ChemSketch.,(Powder Patterns Database),免费,sdpd.univ-lemans.fr/powbase/,13,.,X光衍射晶体结构数据,美国印地安那大学测试的X光衍射晶体结构数据,部分免费,bl-chem-iumsc110.chem.indiana.edu/recipnet/index.jsp,14,.,Bio-Rad的Internet版数据库,Bio-Rad推出可检索80万张谱图的Internet版数据库,