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Molecular Informatics|August 2, 2016
QSPR Approach to Predict Nonadditive Properties of Mixtures. Application to Bubble Point Temperatures of Binary Mixtures of LiquidsI Oprisiu, E Varlamova, E Muratov, et al.
Molecular Informatics|August 3, 2016
Protein Remote Homology Detection by Combining Chou's Pseudo Amino Acid Composition and Profile-Based Protein RepresentationBin Liu, Xiaolong Wang, Quan Zou, et al.
Molecular Informatics|August 3, 2016
Development of QSAR-Improved Statistical Potential for the Structure-Based Analysis of ProteinPeptide Binding AffinitiesKe-Qiang Han, Gang Wu, Fenglin Lv
Molecular Informatics|August 6, 2016
Deep Learning in Drug DiscoveryErik Gawehn, Jan A Hiss, Gisbert Schneider
Molecular Informatics|August 6, 2016
Rational Design of Coumarin Derivatives as CK2 Inhibitors by Improving the Interaction with the Hinge RegionNa Zhang, Wen-Juan Chen, Yue Zhou, et al.
Molecular Informatics|August 6, 2016
Machine Learning Estimation of Atom Condensed Fukui FunctionsQingyou Zhang, Fangfang Zheng, Tanfeng Zhao, et al.
Molecular Informatics|August 6, 2016
Classification of Mixtures of Chinese Herbal Medicines Based on a Self-organizing Map (SOM)Maolin Wang, Li Li, Changyuan Yu, et al.
Molecular Informatics|August 6, 2016
Using Support Vector Machine (SVM) for Classification of Selectivity of H1N1 Neuraminidase InhibitorsYang Li, Yue Kong, Mengdi Zhang, et al.
Molecular Informatics|August 6, 2016
Advances in Activity Cliff ResearchDilyana Dimova, Jürgen Bajorath
Molecular Informatics|August 6, 2016
Designing Multi-target Compound Libraries with Gaussian Process ModelsMichael Bieler, Michael Reutlinger, Tiago Rodrigues, et al.
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