Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge.

Saved in:
Bibliographic Details
Title: Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge.
Authors: Bergazin, Teresa Danielle1, Tielker, Nicolas2, Zhang, Yingying3, Mao, Junjun4, Gunner, M. R.3,4, Francisco, Karol5, Ballatore, Carlo5, Kast, Stefan M.2, Mobley, David L.1,6, dmobley@uci.edu
Source: Journal of Computer-Aided Molecular Design; Jul2021, Vol. 35 Issue 7, p771-802, 32p
Database: Applied Science & Technology Source
Full text is not displayed to guests.
FullText Links:
  – Type: pdflink
Text:
  Availability: 1
Header DbId: aci
DbLabel: Applied Science & Technology Source
An: 151508572
AccessLevel: 2
PubType: Academic Journal
PubTypeId: academicJournal
PreciseRelevancyScore: 0
IllustrationInfo
Items – Name: Title
  Label: Title
  Group: Ti
  Data: Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge.
– Name: Author
  Label: Authors
  Group: Au
  Data: <searchLink fieldCode="AU" term="%22Bergazin%2C+Teresa+Danielle%22">Bergazin, Teresa Danielle</searchLink><relatesTo>1</relatesTo><br /><searchLink fieldCode="AU" term="%22Tielker%2C+Nicolas%22">Tielker, Nicolas</searchLink><relatesTo>2</relatesTo><br /><searchLink fieldCode="AU" term="%22Zhang%2C+Yingying%22">Zhang, Yingying</searchLink><relatesTo>3</relatesTo><br /><searchLink fieldCode="AU" term="%22Mao%2C+Junjun%22">Mao, Junjun</searchLink><relatesTo>4</relatesTo><br /><searchLink fieldCode="AU" term="%22Gunner%2C+M%2E+R%2E%22">Gunner, M. R.</searchLink><relatesTo>3,4</relatesTo><br /><searchLink fieldCode="AU" term="%22Francisco%2C+Karol%22">Francisco, Karol</searchLink><relatesTo>5</relatesTo><br /><searchLink fieldCode="AU" term="%22Ballatore%2C+Carlo%22">Ballatore, Carlo</searchLink><relatesTo>5</relatesTo><br /><searchLink fieldCode="AU" term="%22Kast%2C+Stefan+M%2E%22">Kast, Stefan M.</searchLink><relatesTo>2</relatesTo><br /><searchLink fieldCode="AU" term="%22Mobley%2C+David+L%2E%22">Mobley, David L.</searchLink><relatesTo>1,6</relatesTo>, <i>dmobley@uci.edu</i>
– Name: TitleSource
  Label: Source
  Group: Src
  Data: <searchLink fieldCode="JN" term="%22Journal+of+Computer-Aided+Molecular+Design%22">Journal of Computer-Aided Molecular Design</searchLink>; Jul2021, Vol. 35 Issue 7, p771-802, 32p
PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=aci&AN=151508572
RecordInfo BibRecord:
  BibEntity:
    Identifiers:
      – Type: doi
        Value: 10.1007/s10822-021-00397-3
    Languages:
      – Code: eng
        Text: English
    PhysicalDescription:
      Pagination:
        PageCount: 32
        StartPage: 771
    Titles:
      – TitleFull: Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge.
        Type: main
  BibRelationships:
    HasContributorRelationships:
      – PersonEntity:
          Name:
            NameFull: Bergazin, Teresa Danielle
      – PersonEntity:
          Name:
            NameFull: Tielker, Nicolas
      – PersonEntity:
          Name:
            NameFull: Zhang, Yingying
      – PersonEntity:
          Name:
            NameFull: Mao, Junjun
      – PersonEntity:
          Name:
            NameFull: Gunner, M. R.
      – PersonEntity:
          Name:
            NameFull: Francisco, Karol
      – PersonEntity:
          Name:
            NameFull: Ballatore, Carlo
      – PersonEntity:
          Name:
            NameFull: Kast, Stefan M.
      – PersonEntity:
          Name:
            NameFull: Mobley, David L.
    IsPartOfRelationships:
      – BibEntity:
          Dates:
            – D: 01
              M: 07
              Text: Jul2021
              Type: published
              Y: 2021
          Identifiers:
            – Type: issn-print
              Value: 0920654X
          Numbering:
            – Type: volume
              Value: 35
            – Type: issue
              Value: 7
          Titles:
            – TitleFull: Journal of Computer-Aided Molecular Design
              Type: main
ResultId 1