Robust Free Energy Perturbation Protocols for Creating Molecules in Solution.
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| Title: | Robust Free Energy Perturbation Protocols for Creating Molecules in Solution. |
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| Authors: | Cabeza de Vaca I; Department of Chemistry , Yale University , New Haven , Connecticut 06520-8107 , United States., Zarzuela R; Department of Physics and Astronomy , University of California , Los Angeles , California 90095 , United States., Tirado-Rives J; Department of Chemistry , Yale University , New Haven , Connecticut 06520-8107 , United States., Jorgensen WL; Department of Chemistry , Yale University , New Haven , Connecticut 06520-8107 , United States. |
| Source: | Journal of chemical theory and computation [J Chem Theory Comput] 2019 Jul 09; Vol. 15 (7), pp. 3941-3948. Date of Electronic Publication: 2019 Jun 24. |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: PubMed not MEDLINE |
| Database: | MEDLINE Ultimate |
| FullText | Text: Availability: 0 |
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| Header | DbId: mdl DbLabel: MEDLINE Ultimate An: 31185169 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Robust Free Energy Perturbation Protocols for Creating Molecules in Solution. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AU" term="%22Cabeza+de+Vaca+I%22">Cabeza de Vaca I</searchLink>; Department of Chemistry , Yale University , New Haven , Connecticut 06520-8107 , United States.<br /><searchLink fieldCode="AU" term="%22Zarzuela+R%22">Zarzuela R</searchLink>; Department of Physics and Astronomy , University of California , Los Angeles , California 90095 , United States.<br /><searchLink fieldCode="AU" term="%22Tirado-Rives+J%22">Tirado-Rives J</searchLink>; Department of Chemistry , Yale University , New Haven , Connecticut 06520-8107 , United States.<br /><searchLink fieldCode="AU" term="%22Jorgensen+WL%22">Jorgensen WL</searchLink>; Department of Chemistry , Yale University , New Haven , Connecticut 06520-8107 , United States. – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%22101232704%22">Journal of chemical theory and computation</searchLink> [J Chem Theory Comput] 2019 Jul 09; Vol. 15 (7), pp. 3941-3948. <i>Date of Electronic Publication: </i>2019 Jun 24. – Name: TypePub Label: Publication Type Group: TypPub Data: Journal Article – Name: TitleSource Label: Journal Info Group: Src Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22American+Chemical+Society%22">American Chemical Society </searchLink><i>Country of Publication: </i>United States <i>NLM ID: </i>101232704 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1549-9626 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2215499618%22">15499618 </searchLink><i>NLM ISO Abbreviation: </i>J Chem Theory Comput <i>Subsets: </i>PubMed not MEDLINE |
| PLink | https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=mdl&AN=31185169 |
| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.1021/acs.jctc.9b00213 Languages: – Code: eng Text: English PhysicalDescription: Pagination: StartPage: 3941 Titles: – TitleFull: Robust Free Energy Perturbation Protocols for Creating Molecules in Solution. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Cabeza de Vaca I – PersonEntity: Name: NameFull: Zarzuela R – PersonEntity: Name: NameFull: Tirado-Rives J – PersonEntity: Name: NameFull: Jorgensen WL IsPartOfRelationships: – BibEntity: Dates: – D: 09 M: 07 Text: 2019 Jul 09 Type: published Y: 2019 Identifiers: – Type: issn-electronic Value: 1549-9626 Numbering: – Type: volume Value: 15 – Type: issue Value: 7 Titles: – TitleFull: Journal of chemical theory and computation Type: main |
| ResultId | 1 |
