REAXYS綜合文獻服務與數(shù)據(jù)庫檢索服務

THE

WORKFLOWSOLUTIONS

DESIGN

BY

CHEMISTS

FORCHEMISTSREAXYS產(chǎn)品經(jīng)理李寧2013年5月1REAXYS綜合文獻服務與數(shù)據(jù)庫檢索服務提綱REAXYS簡介REAXYS主要特色REAXYS應用案例REAXYS詳細內(nèi)容REAXYS檢索實例REAXYS新平臺REAXYS集成整合What

exactly

is

Reaxys?A

new

workflow

solution

(工作流解決方案)

forscientists

in

chemistry

and

related

areasA

resource

for

experimentally

validated

substanceproperties

and

reaction

data

(物質(zhì)屬性和反應數(shù)據(jù))presented

with

chemistry

as

the

organizing

principleA

web-based

service(基于網(wǎng)絡服務)

with

an

intuitiveinterface:

easy

touse

for

younger

students

as

well

asspecialist

researchers?2?由化學家設計，根據(jù)化學特性組織信息One

Recordacross

time,

documents

and

publishers信息的收錄PhysicochemicalPropertiesPharmacologyChemical

StructuresChemical

SynthesesWe

excerpt

all

data,

regardless

whether

they

support

the

main

themeof

the

publicationor

are

just

some

factsCrossFire

1.0

Structures&Facts177117721988

1989

199319962007

2009Beilstein

HandbookGmelin

HandbookCrossFire

Commander

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STNREAXYS的發(fā)展歷程REAXYS:4月2日升級只要你需要化學信息文文獻摘檢/索概/文念摘檢索實實驗驗輔輔助

助發(fā)發(fā)表表前前最后最檢后查檢查4月2日后?

多種導出選擇，

實際ELN

/

MsWord

/

Excel

/

PDF?

API

/

SFF

/

內(nèi)容集成登陸頁面改進?

IP地址訪問，無并發(fā)用內(nèi)戶容限增制加，來自會議，書刊，其化學相關(guān)參考書。4月1日以前主要針對合成步驟計劃化合物，物理化性質(zhì)為先內(nèi)容擴充?

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主要相關(guān)專利信息增添功能Reaxys排行編程?

直觀的篩選工具?

分類檢索方便快捷精選題名和摘要方便研究學者進行全領域的文獻檢索。提供更多、更廣泛文獻信息的訪問。FactsFactsFacts15,973

PERIODICALS

COVERINGAGRICULTURAL

ANDBIOLOGICAL

SCIENCESBIOCHEMISTRY,

GENETICSAND

MOLECULAR

BIOLOGYCHEMICAL

ENGINEERINGCHEMISTRYDENTISTRYEARTH

AND

PLANETARY

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AND

MICROBIOLOGYMATERIALS

SCIENCEMEDICINENEUROSCIENCEPHARMACOLOGY,

TOXICOLOGYAND

PHARMACEUTICSPHYSICSAND

ASTRONOMYVETERINARYREAXYS

2013REAXYS收錄與化學相關(guān)和交叉學科的內(nèi)容，方便化學研究學者的獲取。A

UNIVERSE

OFCHEMISTRY

INFORMATIONCHEMISTRY

RESEARCHERCHEMISTRY400

CORE

JOURNALSRELEVANT

CHEMISTRYPATENTSHISTORICAL

CHEMISTRYDATA

(FROM

1771)持續(xù)的創(chuàng)新:BY

CHEMISTS

FOR

CHEMISTSExperimental

proceduresSynthesis

plannerMarkush

view

erSimilarity

searchingReaxys

Structure

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FileReaxys

APIsELN

interoperabilityeMolecules

integrationPubChemintegrationContent

Expansion&

IndexingAnalysis

and

reporting2013年將進行?

內(nèi)容擴充和索引?

新的文獻檢索界面?

Reaxys從頭至尾的工作流程檢索，化學數(shù)據(jù)的深入發(fā)掘和參考文獻的檢查PLAN

?

DISCOVER

?

PUBLISH20092010201120122013Reaxys化學發(fā)現(xiàn)引擎——主要特色REAXYSCATALOGUED

AND

TAXONMISED

BYCHEMISTS

FOR

CHEMISTSUNFOCUSED

RESULTSBIBLIOGRAPHICAPPROACHESSENTIAL

TITLESACROSS

TIME/LITERATUREUSE-CASE

DRIVEN內(nèi)容緊密結(jié)合，方便用戶發(fā)現(xiàn)50,000,000

RESULTS

RETURNEDFURTHER

SEARCHNEEDEDOTHER

DATABASESRELEVANT

ANSWERSREAXYS支持整個工作流程回答你在研究過程中不同階段的不同問題

一些關(guān)鍵問題，如下:Does

a

compound

exist?What

is

known

about

the

compound?Is

thiscompound

commerciallyavailable?How

to

synthesize

thiscompound?What

is

known

about

this

area

of

research?Who

else

is

working

on

thiscompoundor

reaction

type?Reaxys希望能提供相關(guān)和有效的答案，推

動研究進展，幫助你不斷前行。了解其他學者或同行的

研究進展；及時了

解最新動態(tài)實驗快速設計實驗，發(fā)

現(xiàn)或合成化合物報告&交流總結(jié)成果；與其他

學者交流；分享經(jīng)

驗和體會UNDERSTANDWhat

others

have

doneDiscover

what

you

don’t

knowREPORT

&COMMUNICATE EXPERIMENTSummarize

results

Quickly

design

experimentsCheck

what

others

have

Find

or

synthesizedone

compoundsShare

results提供多種途徑方式主頁UNDERSTA

NDEXPERIM

ENTREPORT

&COM

M

UNICATEData

searchformby

subjectSearch

usingchemicalidentifiersPerform

aliteraturesearchOpen

astructuresearch

form自動規(guī)劃:在創(chuàng)建合成路線時自動規(guī)劃合成過程UNDERSTA

NDEXPERIM

ENTREPORT

&COM

M

UNICATE視圖化分析:強大的篩選過濾功能幫助你快捷便利的發(fā)現(xiàn)UNDERSTA

NDEXPERIM

ENTREPORT

&COM

M

UNICATE報告功能:收集并整理相關(guān)信息UNDERSTA

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ENTREPORT

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UNICATEUNDERSTA

NDEXPERIM

ENTREPORT

&COM

M

UNICATE報告功能:分享信息多類型內(nèi)容無縫集成IN-HOUSE

DATA:Seamless

integrationfor

maximized

searchefficiencyPUBCHEM:Includes

biochem.

&pharmaco

informationCOMMERCIAL

AVAILABILITY:Data

and

purchasingpossibilitiesREAXYS

APIs:Combine

the

qualitydata

you

get

fromReaxys

with

in-housecreativity

to

buildnew

solutions

tailor-made

for

your

specificresearch

interestsELECTRONIC

LAB

NOTEBOOKS:Improve

collaboration,minimize

errors,save

timeREAXYS

STRUCTURE

FLAT

FILE:Incorporateinformation

into

datamining

and

internalsearch

systemsReaxys

應用案例——支持科研教學REAXYS支持科研和教學Dr.

M

aikel

Wijtmans,

Assistant

Professor

Amsterdam

Institute

of

Molecules,

Medicines

and

SystemsVU

University

Amsterdam專業(yè)：合成藥物化學（Synthetic

MedicinalChemistry）在教學中應用Reaxys，他希望學生能夠感受化學合成文獻的廣泛性，并且理解信息管理的重要性，最終希望學生能夠在未來的職業(yè)生涯中學會成功使用類似的工具?！癐t

is

important

to

introduce

students

to

state-of-the-artsearch

software

early

on.

We

use

search

software

asearly

as

during

the

second

year

of

the

undergraduateprogram.

Students

need

to

appreciate

such

software

asthe

gateway

to

the

extensive

synthetic

research

effortsthathave

been

done

globally.”Reaxys在本科學生教育中的應用Dr.

Wijtmans會設計一些練習，要求學生們使用分子結(jié)構(gòu)式去尋找文章。It

lets

them

see

the

importance

of

literature

management.

Iwant

them

to

learn

to

find

articles

on

their

own

but

also

to

get

a

sense

of

the

chemistry

research

that

has

already

beendone.Reaxys在碩士學生教育中的應用Dr,

Wijtmans和Dr.

Chris

de

Graaf在相關(guān)課程中設計了稍微復雜一些的研究課題，由學生先進行化合物的設計，在學習一些基礎的逆合成課程過后，進而建議該化合物的合成計劃。The

students,

who

have

a

range

of

backgrounds

withinpharmaceutical

sciences,

have

their

design

and

they

should

use

their

own

knowledge

together

with

Reaxys

to

findliterature

precedents

for

their

compound

or

similar

compound.They

may

discover

that

their

design

has

a

very

low

syntheticfeasibility

so

that

they

have

to

go

back

to

the

drawing

board.We

want

them

to

realize

that

compounds

do

not

‘drop

from

the

sky’,

but

at

the

same

time

that

the

tools

are

there

to

help

them

in

their

retrosynthetic

efforts..Reaxys詳細內(nèi)容物質(zhì)(Substance)反應(Reaction)文獻(Literature)檢索物質(zhì)（substance）結(jié)果（網(wǎng)格）檢索物質(zhì)（substance）結(jié)果（表格）物質(zhì)（substance）詳細內(nèi)容物質(zhì)（substance）的詳細內(nèi)容無論點擊上面，還是此處的鏈接，相關(guān)的屬性數(shù)據(jù)直接下拉顯示。物質(zhì)（substance）的屬性（property）數(shù)據(jù)物質(zhì)（substance）的屬性(property)數(shù)據(jù)所有的反應通過表格的方式清晰呈現(xiàn)；

來源于不同文獻的反應過程被整合在一起該篇文獻的相關(guān)詳細信息反應（reaction）的詳細內(nèi)容對于專利信息，詳細的反應過程描述直接呈現(xiàn)反應（reaction）的詳細內(nèi)容文獻（literature）的詳細內(nèi)容Reaxys檢索實例物質(zhì)檢索反應檢索文獻檢索物質(zhì)屬性檢索聯(lián)合檢索精確結(jié)構(gòu)檢索子結(jié)構(gòu)檢索物質(zhì)結(jié)構(gòu)的不確定查詢不定位R取代基檢索查詢只含有一個乙酸基團的所有苯胺半反應查詢查詢鄰位C上連接一個芳基和

一個鏈狀烷烴的羧基還原為醇羥基的反應全反應查詢兩個片段通過任意結(jié)構(gòu)相連的底物

的轉(zhuǎn)化反應定義化合物鍵的拓撲信息物質(zhì)屬性檢索聯(lián)合檢索Reaxys新平臺REAXYS新舊平臺并行至6月1日新平臺新舊平臺轉(zhuǎn)換鏈接舊平臺REAXYS新舊平臺并行至6月1日新平臺舊平臺新平臺幫助頁面Query

tabCreating

structure????Data

search

formsAnalysis

viewAutoplanReport本次升級的特點——簡潔、直接、便捷REAXYS新平臺界面STRUCTURE

&

REACTIONS檢索NAMES&

FORMULA檢索LITERATURE檢索檢索項的選擇高級檢索個人賬戶登錄支持多種結(jié)構(gòu)編輯器，默認MARVINSKETCH(需要JAVA軟件)安裝兼容插件結(jié)構(gòu)編輯器Reaxys

GenericsTemplate

Library畫完的物質(zhì)結(jié)構(gòu)可以作為文件保存，使用時直接上載。AtomsMapping視圖化的結(jié)果分析視圖化的結(jié)果分析多種篩選功能多種篩選功能

——

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