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  1. bioassay
    appraisal of the biological activity of a substance by testing its effect on an organism and comparing the result with some agreed standard
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  2. macromolecular
    relating to or consisting of or characterized by macromolecules
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  3. power user
    (computing) a computer user who needs the fastest and most powerful computers available
    PubChem Power User Gateway (PUG)

    PUG provides access to PubChem services via a programmatic interface.
  4. molecular formula
    a chemical formula based on analysis and molecular weight
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  5. descriptor
    the phonological or orthographic sound or appearance of a word that can be used to describe or identify something
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  6. spectrometry
    the use of spectroscopes to analyze spectra
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  7. identifier
    a symbol that establishes the identity of the one bearing it
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  8. statistical method
    a method of analyzing or representing statistical data
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  9. peptide
    amide combining the amino group of one amino acid with the carboxyl group of another; usually obtained by partial hydrolysis of protein
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  10. readout
    the information displayed or recorded on an electronic device
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  11. depositor
    a person who has deposited money in a bank or similar institution
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
  12. chemical substance
    material produced by or used in a reaction involving changes in atoms or molecules
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  13. text file
    (computer science) a computer file that contains text (and possibly formatting instructions) using seven-bit ASCII characters
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  14. validate
    confirm the legal force of
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  15. upload
    transfer data to a server, remote computer, or website
    Submissions

    PubChem Deposition Gateway

    This site is for users who want to contribute new data to PubChem and/or test data upload procedures.
  16. validated
    declared or made legally valid
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  17. sketcher
    someone who draws sketches
    The PubChem Sketcher allows a query to be drawn manually.
  18. database
    an organized body of related information
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  19. manually
    by hand
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  20. pug
    a small, short-haired dog breed with a curly tail and flat muzzle
    PubChem Power User Gateway (PUG)

    PUG provides access to PubChem services via a programmatic interface.
  21. computational
    of or involving calculation
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  22. centralize
    concentrate legal power in one main governmental authority
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  23. standardization
    the condition in which a standard has been successfully established
    PubChem Standardization Service

    Standardization, in PubChem terminology, is the processing of chemical structures in the same way used to create PubChem Compound records from contributors' original structures.
  24. standardize
    cause to conform to a norm
    PUG allows users to download data, initiate chemical structure searches, standardize chemical structures and interact with the E-utilities.
  25. referenced
    supported with written references or citations
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  26. user
    someone who employs or takes advantage of something
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  27. algorithm
    a precise rule specifying how to solve some problem
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  28. compound
    a whole formed by a union of two or more elements or parts
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  29. download
    transfer a file or program to a smaller computer
    Downloads

    FTP: PubChem

    This site provides data from the PubChem Substance, Compound and Bioassay databases for download via ftp.
  30. structure
    a complex entity made of many parts
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  31. chemical
    produced by reactions involving atomic or molecular changes
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  32. conserved
    protected from harm or loss
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  33. molecule
    the simplest structural unit of an element or compound
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  34. summarize
    briefly present the main points of something
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  35. depiction
    representation by drawing, painting, etc.
    These Compound records reflect validated chemical depiction information provided to describe substances in PubChem Substance.
  36. deposition
    the act of putting something somewhere
    Submissions

    PubChem Deposition Gateway

    This site is for users who want to contribute new data to PubChem and/or test data upload procedures.
  37. format
    the general appearance of a publication
    Substance and Compound data are provided in ASN.1, SDF and XML formats.
  38. query
    an instance of questioning
    PubChem Structure Search

    PubChem Structure Search allows the PubChem Compound Database to be queried by chemical structure or chemical structure pattern.
  39. substance
    the real physical matter of which a person or thing consists
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  40. interface
    a surface forming a common boundary between two things
    PubChem Power User Gateway (PUG)

    PUG provides access to PubChem services via a programmatic interface.
  41. contributor
    a writer published in a periodical or as part of a book
    Contributors first create a test account where they can test the deposition procedures and preview their data records.
  42. biological
    pertaining to life and living things
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  43. interact
    do something together or with others
    PUG allows users to download data, initiate chemical structure searches, standardize chemical structures and interact with the E-utilities.
  44. search engine
    a computer program that retrieves documents or files or data from a database or from a computer network (especially from the internet)
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  45. terminology
    a system of words used to name things in a discipline
    PubChem Standardization Service

    Standardization, in PubChem terminology, is the processing of chemical structures in the same way used to create PubChem Compound records from contributors' original structures.
  46. assay
    a test of a substance to determine its components
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  47. centralized
    located in one place or under control of a single authority
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  48. protein
    an organic compound essential to living cells
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  49. input
    signal going into an electronic system
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  50. data
    a collection of facts from which conclusions may be drawn
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  51. synonym
    a word that expresses the same or similar meaning
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  52. conserve
    keep in safety and protect from harm, loss, or destruction
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  53. FTP
    protocol that allows users to copy files between their local system and any system they can reach on the network
    Downloads

    FTP: PubChem

    This site provides data from the PubChem Substance, Compound and Bioassay databases for download via ftp.
  54. initiate
    set in motion, start an event or prepare the way for
    PUG allows users to download data, initiate chemical structure searches, standardize chemical structures and interact with the E-utilities.
  55. specify
    be particular about
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  56. procedure
    a particular course of action intended to achieve a result
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  57. electronically
    by electronic means
    PubChem Substance

    PubChem Substance records contain substance information electronically submitted to PubChem by depositors.
  58. molecular
    relating to the simplest units of an element or compound
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  59. additionally
    in addition, by way of addition; furthermore
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  60. gateway
    an entrance that can be closed by a gate
    Submissions

    PubChem Deposition Gateway

    This site is for users who want to contribute new data to PubChem and/or test data upload procedures.
  61. CID
    the United States Army's principal law enforcement agency responsible for the conduct of criminal investigations for all levels of the Army anywhere in the world
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  62. filter
    device that removes something from what passes through it
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  63. resource
    aid or support that may be drawn upon when needed
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  64. search
    look or seek
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  65. statistical
    of or relating to the interpretation of quantitative data
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  66. tool
    an implement used to perform a task or job
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  67. provide
    give something useful or necessary to
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  68. link
    connect, fasten, or put together two or more pieces
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  69. update
    modernize
    Full downloads of the databases are available along with daily, weekly and monthly updates for Substance and Compound.
  70. biology
    the science that studies living organisms
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  71. screening
    the display of a motion picture
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  72. file
    record in a public office or in a court of law
    See the README files for more information.
  73. structural
    relating to the composition of something
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  74. Mass
    a sequence of prayers constituting the Christian Eucharistic rite
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  75. spectrum
    a broad range of related objects, values, or qualities
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  76. clustered
    clustered together but not coherent
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  77. links
    a golf course that is built on sandy ground near a shore
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  78. record
    anything providing permanent evidence about past events
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
  79. submit
    yield to the control of another
    PubChem Substance

    PubChem Substance records contain substance information electronically submitted to PubChem by depositors.
  80. test
    standardized procedure for measuring sensitivity or aptitude
    Submissions

    PubChem Deposition Gateway

    This site is for users who want to contribute new data to PubChem and/or test data upload procedures.
  81. similarity
    the quality of being alike
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  82. processing
    preparing or putting through a prescribed procedure
    PubChem Standardization Service

    Standardization, in PubChem terminology, is the processing of chemical structures in the same way used to create PubChem Compound records from contributors' original structures.
  83. calculate
    make a mathematical computation
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  84. access
    the right to enter
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  85. pathway
    a trodden path
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  86. web site
    a computer connected to the internet that maintains a series of web pages on the World Wide Web
    This includes any chemical structure information submitted, as well as chemical names, comments, and links to the depositor's web site.
  87. classification
    the basic cognitive process of arranging into categories
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  88. contain
    hold or have within
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  89. correspond
    take the place of or be parallel or equivalent to
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  90. preview
    a preliminary introduction to or inspection of something
    Contributors first create a test account where they can test the deposition procedures and preview their data records.
  91. sequence
    a following of one thing after another in time
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  92. cluster
    a grouping of a number of similar things
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  93. include
    have as a part; be made up out of
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  94. searching
    exploring thoroughly
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  95. Service
    Canadian writer who wrote about life in the Yukon Territory
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  96. available
    obtainable or accessible and ready for use or service
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  97. develop
    progress or evolve through a process of natural growth
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  98. screen
    partition consisting of a decorative frame or panel that serves to divide a space
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  99. hypothesis
    a tentative insight that is not yet verified or tested
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  100. utility
    the quality of being of practical use
    PUG allows users to download data, initiate chemical structure searches, standardize chemical structures and interact with the E-utilities.
  101. deposit
    the act of putting something somewhere
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  102. identify
    recognize as being
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  103. allow
    make it possible for something to happen
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  104. site
    the piece of land on which something is located
    This includes any chemical structure information submitted, as well as chemical names, comments, and links to the depositor's web site.
  105. testing
    experimentation to determine how well something works
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  106. consist
    have its essential character
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  107. soap
    a cleansing agent made from the salts of vegetable or animal fats
    PUG can be accessed using either standard URLs or via SOAP.
  108. contribute
    give, provide, or supply something
    Submissions

    PubChem Deposition Gateway

    This site is for users who want to contribute new data to PubChem and/or test data upload procedures.
  109. submission
    the act of surrendering power to another
    Submissions

    PubChem Deposition Gateway

    This site is for users who want to contribute new data to PubChem and/or test data upload procedures.
  110. formula
    a group of symbols that make a mathematical statement
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  111. using
    an act that exploits or victimizes someone
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  112. score
    a number that expresses accomplishment in a game or contest
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  113. create
    bring into existence
    Contributors first create a test account where they can test the deposition procedures and preview their data records.
  114. service
    an act of help or assistance
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  115. monthly
    of or occurring or payable every month
    Full downloads of the databases are available along with daily, weekly and monthly updates for Substance and Compound.
  116. domain
    a particular environment or walk of life
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  117. activity
    any specific behavior
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  118. information
    knowledge acquired through study or experience
    These Compound records reflect validated chemical depiction information provided to describe substances in PubChem Substance.
  119. classical
    of the most highly developed stage of an early civilization
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  120. scores
    a large number or amount
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  121. efficient
    being effective without wasting time, effort, or expense
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  122. corresponding
    similar especially in position or purpose
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  123. probability
    a measure of how likely it is that some event will occur
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  124. blast
    a sudden, loud sound
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  125. alternative
    one of a number of things from which only one can be chosen
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  126. unique
    the single one of its kind
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  127. developed
    being changed over time, as to be stronger or more complete
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  128. identity
    the characteristics by which a thing or person is known
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  129. reflect
    throw or bend back from a surface
    These Compound records reflect validated chemical depiction information provided to describe substances in PubChem Substance.
  130. description
    the act of depicting something
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  131. pattern
    a repeated design, structure, or arrangement
    PubChem Structure Search

    PubChem Structure Search allows the PubChem Compound Database to be queried by chemical structure or chemical structure pattern.
  132. calculated
    carefully thought out in advance
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  133. weekly
    a periodical that is published every week
    Full downloads of the databases are available along with daily, weekly and monthly updates for Substance and Compound.
  134. specific
    stated explicitly or in detail
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  135. relationship
    a mutual connection between people
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  136. analysis
    abstract separation of something into its various parts
    Users also can download their analyses and data tables.
  137. supply
    circulate or distribute or equip with
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
  138. use
    put into service
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  139. smart
    characterized by quickness and ease in learning
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  140. web
    an intricate network suggesting something that was formed by weaving or interweaving
    This includes any chemical structure information submitted, as well as chemical names, comments, and links to the depositor's web site.
  141. engine
    motor that converts energy into work or motion
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  142. services
    performance of duties or provision of space and equipment helpful to others
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  143. handle
    touch, lift, or hold
    This service lets users see how PubChem would handle any structure they would like to submit.
  144. significant
    rich in implication
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  145. describe
    give a statement representing something
    These Compound records reflect validated chemical depiction information provided to describe substances in PubChem Substance.
  146. names
    verbal abuse; a crude substitute for argument
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  147. supported
    held up or having the weight borne especially from below
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  148. proceed
    move ahead; travel onward in time or space
    They may then proceed to a deposition account whereby their data will be uploaded into the public database.
  149. page
    one side of one leaf of a book or other document
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  150. reference
    the act of consulting
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  151. comment
    a statement that expresses a personal opinion
    This includes any chemical structure information submitted, as well as chemical names, comments, and links to the depositor's web site.
  152. contained
    gotten under control
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  153. smile
    a facial expression with the corners of the mouth turned up
    Numerous download formats are available, including SDF, XML and SMILES.
  154. used to
    in the habit
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  155. branch
    a division of a stem arising from the main stem of a plant
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  156. text
    the words of something written
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  157. standard
    a basis for comparison
    PUG can be accessed using either standard URLs or via SOAP.
  158. result
    something that follows as a consequence
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  159. cross
    a marking that consists of lines that intersect each other
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  160. group
    any number of entities (members) considered as a unit
    A centralized page providing access and links to resources developed by the Structure Group of the NCBI Computational Biology Branch (CBB).
  161. library
    a place containing books and other materials for reading
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  162. store
    a mercantile establishment for the sale of goods or services
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  163. numerous
    amounting to a large indefinite number
    Numerous download formats are available, including SDF, XML and SMILES.
  164. method
    a way of doing something, especially a systematic way
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  165. used
    previously owned by another
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  166. account
    a record or narrative description of past events
    Contributors first create a test account where they can test the deposition procedures and preview their data records.
  167. cover
    provide with a covering or cause to be covered
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  168. level
    a relative position or degree of value in a graded group
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  169. process
    a particular course of action intended to achieve a result
    PubChem Standardization Service

    Standardization, in PubChem terminology, is the processing of chemical structures in the same way used to create PubChem Compound records from contributors' original structures.
  170. hit
    deal a blow to, either with the hand or with an instrument
    OMSSA scores significant hits with a probability score developed using classical hypothesis testing, the same statistical method used in BLAST.
  171. daily
    of or belonging to or occurring every day
    Full downloads of the databases are available along with daily, weekly and monthly updates for Substance and Compound.
  172. drawn
    showing the wearing effects of overwork or care or suffering
    The PubChem Sketcher allows a query to be drawn manually.
  173. conditions
    the context that influences the performance of a process
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  174. original
    preceding all others in time
    PubChem Standardization Service

    Standardization, in PubChem terminology, is the processing of chemical structures in the same way used to create PubChem Compound records from contributors' original structures.
  175. ways
    structure consisting of a sloping way down to the water from the place where ships are built or repaired
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  176. property
    something owned
    Additionally, calculated properties and descriptors are available for searching and filtering of chemical structures.
  177. support
    the act of bearing the weight of or strengthening
    Users may also specify the structural query input by PubChem Compound Identifier (CID), SMILES, SMARTS, InChI, Molecular Formula, or by upload of a supported structure file format.
  178. condition
    a mode of being or form of existence of a person or thing
    PubChem BioAssay

    Consists of deposited bioactivity data and descriptions of bioactivity assays used to screen the chemical substances contained in the PubChem Substance database, including descriptions of the conditions and the readouts (bioactivity levels) specific to the screening procedure.
  179. same
    same in identity
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
  180. can
    airtight sealed metal container for food or drink, etc.
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  181. study
    applying the mind to learning and understanding a subject
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  182. small
    limited or below average in number or quantity or magnitude
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  183. name
    a language unit by which a person or thing is known
    PubChem Compound

    Contains unique, validated chemical structures (small molecules) that can be searched using names, synonyms or keywords.
  184. system
    a group of independent elements comprising a unified whole
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  185. table
    furniture having a smooth flat top supported by legs
    Users also can download their analyses and data tables.
  186. view
    the visual percept of a region
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  187. may
    thorny shrub of a small tree having white to scarlet flowers
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
  188. as well
    in addition
    This includes any chemical structure information submitted, as well as chemical names, comments, and links to the depositor's web site.
  189. different
    unlike in nature, quality, form, or degree
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
  190. either
    also, likewise, as well
    PUG can be accessed using either standard URLs or via SOAP.
  191. also
    in addition
    Users also can download their analyses and data tables.
  192. public
    not private
    They may then proceed to a deposition account whereby their data will be uploaded into the public database.
  193. open
    affording free passage or access
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  194. known
    apprehended with certainty
    Open Mass Spectrometry Search Algorithm (OMSSA) Search

    An efficient search engine for identifying MS/MS peptide spectra by searching libraries of known protein sequences.
  195. within
    on the inside
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  196. help
    give assistance; be of service
    These resources cover databases and tools to help in the study of macromolecular structures, conserved domains and protein classification, small molecules and their biological activity, and biological pathways and systems.
  197. along
    in line with a length or direction
    Full downloads of the databases are available along with daily, weekly and monthly updates for Substance and Compound.
  198. are
    a unit of surface area equal to 100 square meters
    Structures stored within PubChem Compounds are pre-clustered and cross-referenced by identity and similarity groups.
  199. full
    containing as much or as many as is possible or normal
    Full downloads of the databases are available along with daily, weekly and monthly updates for Substance and Compound.
  200. way
    how something is done or how it happens
    Tools

    BioAssay Services

    Tools that summarize the biological test results in the PubChem database and provide alternative ways to view bioassay results and structure-activity relationships.
  201. let
    actively cause something to happen
    This service lets users see how PubChem would handle any structure they would like to submit.
  202. set
    put into a certain place or abstract location
    PubChem Download Service

    This service allows users to download compound or substance records corresponding to a set of PubChem identifiers, which can be supplied manually or through a text file.
  203. power
    possession of the qualities required to do something
    PubChem Power User Gateway (PUG)

    PUG provides access to PubChem services via a programmatic interface.
  204. more than
    (comparative of `much' used with mass nouns) a quantifier meaning greater in size or amount or extent or degree
    The compound records may link to more than one PubChem Substance record if different depositors supplied the same structure.
Created on Fri Dec 02 14:48:21 EST 2011

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