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Optimized SQE atomic charges for peptides accessible via a web application.
Schindler, Ondrej; Racek, Tomás; Marsavelski, Aleksandra; Koca, Jaroslav; Berka, Karel; Svobodová, Radka.
Affiliation
  • Schindler O; CEITEC-Central European Institute of Technology, Masaryk University, Kamenice 5, 602 00, Brno, Czech Republic.
  • Racek T; National Centre for Biomolecular Research, Faculty of Science, Masaryk University, Kamenice 5, 625 00, Brno, Czech Republic.
  • Marsavelski A; CEITEC-Central European Institute of Technology, Masaryk University, Kamenice 5, 602 00, Brno, Czech Republic.
  • Koca J; National Centre for Biomolecular Research, Faculty of Science, Masaryk University, Kamenice 5, 625 00, Brno, Czech Republic.
  • Berka K; Faculty of Informatics, Masaryk University, Botanická 68a, 602 00, Brno, Czech Republic.
  • Svobodová R; Division of Biochemistry, Department of Chemistry, Faculty of Science, University of Zagreb, Horvatovac 102a, 10000, Zagreb, Croatia.
J Cheminform ; 13(1): 45, 2021 Jun 30.
Article in En | MEDLINE | ID: mdl-34193251

Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Cheminform Year: 2021 Document type: Article Affiliation country: Czech Republic Country of publication: United kingdom

Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Cheminform Year: 2021 Document type: Article Affiliation country: Czech Republic Country of publication: United kingdom