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Molecular Informatics|July 19, 2018
RadAA: A Command-line Tool for Identification of Radical Amino Acid Changes in Multiple Sequence AlignmentsInge Seim, Andrew M Baker, Lisa K Chopin
Molecular Informatics|July 28, 2018
Flap-site Fragment Restores Back Wild-type Behaviour in Resistant Form of HIV ProteaseAdriano Luchi, Emilio Angelina, Lucrecia Bogado, et al.
Molecular Informatics|August 3, 2018
GOWAWA Aggregation Operator-based Global Molecular Characterizations: Weighting Atom/bond Contributions (LOVIs/LOEIs) According to their Influence in the Molecular EncodingCésar R García-Jacas, Lisset Cabrera-Leyva, Yovani Marrero-Ponce, et al.
Molecular Informatics|September 2, 2016
Simultaneous Prediction of four ATP-binding Cassette Transporters' Substrates Using Multi-label QSARNatália Aniceto, Alex A Freitas, Andreas Bender, et al.
Molecular Informatics|April 29, 2017
Computer-aided Dereplication and Structure Elucidation of Natural Products at the University of ReimsAli Bakiri, Bertrand Plainchont, Vicente de Paulo Emerenciano, et al.
Molecular Informatics|June 7, 2017
DMclust, a Density-based Modularity Method for Accurate OTU Picking of 16S rRNA SequencesZe-Gang Wei, Shao-Wu Zhang, Yi-Zhai Zhang
Molecular Informatics|April 20, 2018
Could Adenosine Recognize its Receptors with a Stoichiometry Other than 1 : 1?Giuseppe Deganutti, Veronica Salmaso, Stefano Moro
Molecular Informatics|July 4, 2017
Discriminating Agonist from Antagonist Ligands of the Nuclear Receptors Using Different Chemoinformatics ApproachesNathalie Lagarde, Solenne Delahaye, Aurore Jérémie, et al.
Molecular Informatics|June 15, 2018
Machine Learning Classification Models to Improve the Docking-based Screening: A Case of PI3K-Tankyrase InhibitorsVladimir P Berishvili, Andrew E Voronkov, Eugene V Radchenko, et al.
Molecular Informatics|June 30, 2020
Using Language Representation Learning Approach to Efficiently Identify Protein Complex Categories in Electron Transport ChainTrinh-Trung-Duong Nguyen, Nguyen-Quoc-Khanh Le, Quang-Thai Ho, et al.
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