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Molecule editor applet and 2D/3D viewer (Marvin), database and complete cheminformatics toolkit (JChem) with API
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272:- 3D Structures of organic molecules with physical properties. This database is released under the
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This page is meant to be a repository for links to sites containing useful chemical data.
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An extensive list of open source, freeware and commercial chemistry programs for Linux.
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282:- Free compound search by chemical name, CAS Number, structure and substructure
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that supports SMILES/SMARTS, InChI, and all common chemical file formats
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The
Edinburgh Collection of Open Software for Simulation and Education
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56:: NMR, IR, Raman, MS, from a Japanese govt. institute, in English.
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Osiris
Property Explorer - Calculation of drug-relevant properties
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Compound, substance, and bioactivity data, advanced search panel
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is a collection of links and references that are useful for
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Calculation of molecular descriptors and bioactivity score
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List of elements, sortable by name, symbol, atomic number
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ESIS (European chemical
Substances Information System)
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Improved Vapour
Pressure and Boiling Point Calculator
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Where to find MSDS on the
Internet (very extensive)
412:Directory of Free Full-Text Journals in Chemistry
469:Molar mass and elemental composition calculator
228:Specialized Information Services (SIS) Division
573:Simple IDEAL Shortcut Distillation Procedures
528:Simple IDEAL Boiling Point Diagram Calculator
257:- Ligands, small molecules and monomers from
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176:Compound data (cookie-based accession limit)
907:ENVIRONMENTAL HEALTH & SAFETY RESOURCES
71:The Chemical Database (University of Akron)
251:- Chemical Entities of Biological Interest
152:Compound, substance, and bioactivity data
100:-related work. This includes free online
24:Knowledge:WikiProject Chemicals/Data book
799:Sigma-Aldrich Risk and Safety Statements
83:Chemical Profiles (The Innovation Group)
77:Production numbers, industrial profiles
789:MSDS Authoring FAQ (Nexreg Compliance)
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232:National Library of Medicine (NLM))
88:Chemical Information from ImageWave
753:Material Safety Data Sheets (MSDS)
265:http://www.dechema.de/detherm.html
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538:Simplified Binary VLLE Calculator
134:Free compound search by structure
518:Water Vapour Pressure Calculator
218:Selected and commented reactions
146:The free chemistry search engine
919:Category:Free software websites
882:CHIN list of chemical databases
498:WWW Chemical Engineer's Toolkit
334:Dictionary of chemical formulas
18:Knowledge:WikiProject Chemicals
902:Chemical Engineering Resources
543:Binary Nonideal VLE Calculator
437:PubChem online molecule editor
330:Inorganic compounds by element
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784:Cornell University MSDS index
683:Structure drawing and storage
639:List of alchemical substances
747:Emergency Response Guidebook
533:Approximate LLE calculations
451:Structure to image converter
270:Chemical Structures Database
60:MSDS & other safety info
897:Chemistry at Sutton College
689:File format interconversion
643:Knowledge naming convention
548:Simple IDEAL VLE Calculator
314:List of inorganic compounds
126:Substance and reaction data
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871:Knowledge chemistry portal
849:Risk and Safety Statements
845:Material safety data sheet
713:molecule viewer for SMILES
463:Chemical equation balancer
394:digital object identifiers
255:MSDChem (Ligand Chemistry)
140:Compounds, analytical data
132:Organic Compounds Database
445:SMILES to image converter
318:List of organic compounds
164:Compound data and spectra
922:Category:Data management
563:Heterogeneous Azeotropes
508:The Molecular Typewriter
374:scientific search engine
513:Pure Component Databank
170:Compounds search engine
695:Molecule editor applet
593:Ternary Distillation B
588:Ternary Distillation A
553:Non-Ideal x-y Diagrams
162:NIST Chemistry WebBook
43:NIST Chemistry WebBook
887:NIH list of resources
794:MSDS FAQ (MSDSWriter)
427:partition coefficient
116:Free online resources
112:, and various tools.
322:List of biomolecules
224:Search for reactions
693:JME molecule editor
310:CAS Registry Number
242:ChemIDplus Advanced
94:Chemistry resources
37:Physical properties
916:Category:Chemistry
821:Hazardous material
774:www.msdssearch.com
635:IUPAC nomenclature
622:IUPAC nomenclature
558:Azeotrope Databank
400:Chemical Databases
198:Bordwell pKa Table
168:Chemical catalogue
102:chemical databases
857:List of S-phrases
853:List of R-phrases
811:Reference catalog
368:Abstract database
306:Chemical database
280:R&D Chemicals
216:Organic Synthesis
110:computer programs
22:(Redirected from
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138:Chemical catalog
104:, publications,
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274:BSD license
829:NSC number
805:References
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360:References
209:values in
174:Chemfinder
833:UN number
825:Materials
818:See also:
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662:See also:
628:See also:
599:See also:
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287:See also:
182:Spectra (
121:Databases
98:chemistry
863:See also
705:ChemAxon
701:freeware
675:Software
406:Journals
392:Resolve
144:Chmoogle
493:Tools:
461:Balance
386:Patents
380:Patents
302:GenBank
290:PubChem
261:entries
230:of the
150:PubChem
106:patents
741:Safety
727:SMILES
602:SMILES
479:ECOSSE
467:MMCalc
424:VCCLAB
372:scirus
366:PubMed
346:Patent
338:PubMed
298:PubMed
294:Entrez
184:UV/Vis
841:RTECS
731:InChI
631:IUPAC
606:InChI
396:(DOI)
384:USPTO
354:USPTO
249:ChEBI
16:<
711:Jmol
429:log
211:DMSO
180:SDBS
54:SDBS
390:DOI
350:EPO
342:DOI
259:PDB
192:NMR
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