Journal of Cheminformatics | Home page

Journal of Cheminformatics | Home page

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1. Content Type:Software

     |  8 April 2019

   TeachOpenCADD: a teaching platform for computer-aided drug design using open source packages and data

   Authors:Dominique Sydow, Andrea Morger, Maximilian Driller and Andrea Volkamer
2. Content Type:Research Article

     |  8 April 2019

   Detecting drug communities and predicting comprehensive drug–drug interactions via balance regularized semi-nonnegative matrix factorization

   Authors:Jian-Yu Shi, Kui-Tao Mao, Hui Yu and Siu-Ming Yiu
3. Content Type:Methodology

     |  3 April 2019

   Methodology of aiQSAR: a group-specific approach to QSAR modelling

   Authors:Kristijan Vukovic, Domenico Gadaleta and Emilio Benfenati
4. Content Type:Research Article

     |  2 April 2019

   QligFEP: an automated workflow for small molecule free energy calculations in Q

   Authors:Willem Jespers, Mauricio Esguerra, Johan Åqvist and Hugo Gutiérrez-de-Terán
5. Content Type:Research Article

     |  28 March 2019

   Algorithm-supported, mass and sequence diversity-oriented random peptide library design

   Authors:Daniela Kalafatovic, Goran Mauša, Toni Todorovski and Ernest Giralt