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Basic Training for TMU
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Agenda
• Introduction• Who is CAS/SciFinder ?• The contents of SciFinder• What can SciFinder do for you ?• Why SciFinder ?• Apply for ID/PW• Live Demo• Q & A
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• CAS, the global leader in chemical information, and
a division of the American Chemical Society
• Provides the world’s largest and most current
collection of chemical and related scientific
information, including authoritative collection of
substance information
• Products - SciFinder, STN, STN Express.
Chemical Abstrates Service
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SciFinder
It is a research discovery tool produced by Chemical Abstracts Service (CAS)
One single source, you can explore scientific information in journals and patent literature from around the world
Cover a wide range of scientific disciplines, like biomedical sciences, chemistry, engineering, material science, agricultural science, and more!
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Database contents in SciFinder
CASREGISTRYSM
MEDLINE CASREACT®
CHEMLIST® CHEMCATS
®
CA Plus®
Explore by research topic, author name, company
Explore by Reaction
Explore by Substance name, Structure
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What you can do in SciFinder ?
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Searching the scientific literature
Primary literature• Original information reported by researchers• Journal articles, patents, technical paper,
proceedings, dissertations etc. Secondary literature
• Summarizing the research and data from many different sources
• Abstracts, indexes, review, handbooks, encyclopedias and dictionaries etc
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Chemical and trade name Structure Molecular formula CAS registry number Supplier information Physical and chemical properties
• Conduct laboratory experiment and confirm the results
Molecular weight pKa Solubility
Boiling point Lipinski ADME
Melting point LD50 Toxicity
pH Vapor pressure Etc…
Substance information
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Searching Reaction information For preparation and synthesis of a substance Starting materials, intermediates, products Reaction condition, catalyst and product yields
Searching spectroscopic information Locate the spectra data for a substance Identify the unknown compound and structure C-13, NMR, IR, UV, Mass spectra and so on..
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More than 900 editorial scientists in CAS
• Around 900 PhD involve in the
reference edit.
• More than 10,000 Institutes
around the world use SciFinder.
The Ohio State University (OSU) campus
CAS scientists on the lawn.
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Science & Tech.
Originalpublications
caffeinebioactiveCAS RN
CAS Experts
Valuable A & I
Scientists
CAS Editors
Human Indexing
Establish the Largest, Authority and Reliability database around the world!
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Shoulder of Giants
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Chemical Abstract History
~2009
光盘
纸本 1907
1977
1995 2002 Taiwan
Taiwan(Corp. Gov.
Research Center)
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• 有機化學 - • 脂肪族• 合成物質• 生物鹼• 類固醇• 雜環、萜類
Chemical Abstracts is divided into 80 different sections
• 應用化學 - • 燃料、爆破• 冶金• 電化學• 化妝品• 污染防治、• 水處理
• 生物化學 -
• 藥理學、毒理學
• 農化調節
• 哺乳動物賀爾蒙
• 微生物
• 食品營養 • 高分子 - • 塑膠合成• 染劑塗料• 紡織纖維• 介面活性• 工業皮革
• 物理、無機、分析 - • 反應動力學• 核子技術• 相位平衡• 光電、質量學• 輻射、磁性
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15CAS databases cover patents from 59 patent authorities around the world.
Patents from around the World
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Why SciFinder ?
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• The world's largest and most comprehensive collection of chemistry-related information • The only integrated scientific resource of journals and patent information
• The most timely scientific information source
• Intellectually analyzed content Concept information, Comprehensive substance information
• Links from references to electronic journal and patent documents
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收集發表於期刊、專利文件及其它相關文獻資料包含書目、摘要以及索引資訊資料每日更新超過 3,000筆1840 ~ present*
總收錄超過 3,000萬筆資料收錄全世界 59個專利局授權之專利資料超過 10,000種世界知名科學期刊翻譯超過 50 種語言與 185 個不同國家的科學文
章
CAplus
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• 由美國國家醫學圖書館 (NLM) 製作發行的生物醫學文獻資料庫,其中包含生醫領域著名的 4,800 多種期刊*
• 資料包含書目、摘要以及索引資訊• 資料每周 4 次更新超過 14,000 筆• 1949 ~ present
• 總收錄超過 1,700 萬筆資料•
•
MEDLINE
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• 物質資料庫• CAS RNs* 、 化學結構、 化學名、特性 • GenBank 資料庫
• 1957 ~ present• 目前亦包含許多回溯到 1900s 的物質資訊
• 資料每日新增超過 12,000 筆物質• 收錄超過 39,739,746 筆有機與無機物質資料 **• 收錄超過 60,448,135 筆基因序列資料 **
CAS REGISTRY
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• 化學反應資料庫
• 產物、反應物結構式• 產率等實驗數據
• 1840~ present
• 資料每週更新 600~1,300 筆• 收錄超過 15,957,087 筆單步驟及多步驟反應資料
CASREACT
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• 化學品目錄
• 提供查詢與篩選全球化學品及供應商名錄
• 不定期更新資料以保持業界最新消息• 提供超過 25,204,467 筆化學品、 1,000 種化學型錄以
及超過全球 900 家供應商資訊
•
CHEMCATS
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• 含括 19 個國家化學品管制相關資訊,如美國、歐洲、中國、日本、澳洲以及以色列等各國• 管制範圍如化學名、相似物、供應商等
• 資料每週更新超過 50 筆 • 收錄超過 247,465 筆化學品管制資訊 *
CHEMLIST
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SciFinder Web 網址 https://scifinder.cas.org-https 連線透過 “ port 443”; IP: 134.243.5.42
- 適用 Windows/Mac 。 IE ; FireFox ; Safari ; Chrome
-Java Runtime Environment (JRE 6.x) ; Java Plug-In
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請尊重智財權及著作權, 勿違法使用及大量下載 ~
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申請 SciFinder 個人帳號密碼
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•a). email 填寫時必須使用學校專屬的 email domain 才可通過認證。
•b). username 必須是特別獨立的以及包含 5-15 字元,可以全部都是字母,或包含有數字或以下特殊符號 ( 紅色標示 ) : - (dash) ; _ (underscore) ; . (period) ; @ (at symbol)
•c). password 必須包含 7-15 字元,並且包含以下任三種的範圍 ( 紅色標示 ) :• 字母 ; 混合的大小寫字母 ; 數字 ; 特殊符號 ( 如 @, #, %, &, *等 )
•d). 填寫安全提問以便日後忘記密碼時可供查詢,完成後按” Register” 。
注意事項
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Confirm letter from CAS
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學習更多關於 CAS/SciFinder 的知識
https://casevents.webex.com
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SciFinder Web 新介面介紹 :全新介面,加強個人化功能 (KMP) 與直覺式檢索頁面… ..
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Preferences: 可設定常用的檢索方式為歡迎頁面,以及 KMP 的通知功能 ~
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Help: 可幫助您更容易了解 SF Web 的使用方式,任何時間點選 亦可連結至說明頁面 ~
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• 忘記帳號或密碼時…
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針對某一疾病 , 查訊目前以專利的治療方式 •實例說明 : Mad cow disease 狂牛症
•Query: Treat (therapy) for SLE
DEMO
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如何找特定取代基出現在 C60 任意位置
C60
單取代雙取代 三取代
範例一
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如何找任意取代基出現在 C60 特定位置
C60
?
?
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如何從文獻中找出有興趣之化合物作修飾
Adv. Funct. Mater.
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可選擇多種方式如主題、作者名、公司名…等進行文獻查詢 !! 下方並有限制條件區可供設定。
文獻檢索 : Explore Reference
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文獻檢索得到的結果在上方有快速串連反查區;右方則是自動分析作者名稱。
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感興趣 ( 或最終篩選得到 ) 的文章,可透過” Link” 功能快速複製一串 URL( 物質 / 反應檢索亦同 ) ,此 URL 可分享給他人。只要登入 SF Web 並貼上此 URL即可快速獲得此篇文獻,減少重複查詢的工作。
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文獻結果可以不同形式排序,如登錄號、作者名、發表年份、標題等
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分析欄位增加” CA Concept Heading” ,可更清楚了解文獻檢索結果中包含的”重要觀念”。點選” Full Analysis” 可秀出每個分析選項的筆數,也可點選” more”做完整的分析查看。
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點選感興趣的分析項目 (ex. Metals) ,結果會先以黃色區塊表示,並在其他分析項目中以黃色表示重複文章所佔比例。若此分析結果為所需,則點選” keep analysis”!!
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Keep analysis 結果 !!
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檢索策略 /步驟會以”字串路徑”的方式於上方保留下來,不再需要點選”上一步”,直接點選檢索策略中的路徑任何一步驟,即可回到該檢索結果 !!
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分類 (Categorize) ,位於分析欄位下方,點選後會出現大型對話框,選擇每一階層感興趣的欄位,點選” Refine”即可進行分類 !!
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點選文章進入後,右側是文章相關資訊,下方為經 CA科學家整理後的精華區塊,如Indexing 、 Concepts 、 Substances.. 等 !!
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Concepts 區塊提供超連結點選,方便研究人員快速轉換至相關主題 !!
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Substances 區塊提供本文章中相關物質超連結點選,方便研究人員快速查看相關物質資訊,下方並有此物質在本文章中扮演的角色說明 !!
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可選擇直接繪製結構 ( 點小圖出現畫板 ) ,或可從分子式、物質定義來進行查詢 ! 下方有限制條件區可供設定。
物質檢索 : Explore Substance
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承接軟體版強大的工具列設計理念,方便使用者更輕鬆的選擇功能。如整合的環系統與模板設計、使用者定義功能… .
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Repeating tool 及 VAP 可針對複雜結構進行模糊參數設定,檢索時亦有 SSM模組(Substructure, Similarity) 可供模糊比對搜尋。
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支援多種 Import/Export格式,方便研究人員快速轉換,如 ChemDraw, ISIS/Draw, MDL 等。
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Substance Detail :更清楚易懂的排列方式,讓研究人員快速掌握物質的相關性質與連結相關資訊。
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Substance Detail :專利中屬於預測性的物質 (Prophetic) 亦會被特別標示。
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Substance Detail :經由系統推導演算所預測的物質特性,並已完整分類。
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Substance Detail :經由實驗所得到的物質特性,並已完整分類。可點選各類型的光譜圖參考 (見下頁 ) 。
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Export檔案支援多種格式,如akx, pdf, rtf, txt 。
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點選小圖後出現畫板,較物質檢索多出 5 個專屬按鍵,可以此查詢反應。 下方有限制條件區可供設定。
反應檢索 : Explore Reactions
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承接軟體版強大的工具列設計理念,方便使用者更輕鬆的選擇功能。
![Page 62: 1 Basic Training for TMU. 2 Agenda Introduction Who is CAS/SciFinder ? The contents of SciFinder What can SciFinder do for you ? Why SciFinder ? Apply](https://reader037.vdocuments.mx/reader037/viewer/2022102818/56649d555503460f94a32a40/html5/thumbnails/62.jpg)
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簡潔的檢索結果瀏覽頁面,自動完成分析統計; Link 功能快速複製與分享重要檢索結果。
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Export檔案支援多種格式,如akx, pdf, rtf 。
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自反應式中,反查產物的物質資料明細。
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其他常用功能 :
Answer Sets: 可對 2 個以上的答案群集進行 combine 功能。
History: 可下載最新 10 筆檢索歷程,方便研究人員熟悉檢索策略。
KMP results: 檢索結果更新通知功能設定。
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可個別以”文獻”、”物質”、”反應”進行 2 個以上答案群集的 combine 功能。
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可下載最新 10 筆歷程,方便研究人員了解檢索策略。
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可隨時對 KMP 更新通知進行調整。
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Advanced Reaction Searching