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Molecular Informatics|July 28, 2016
Towards Proteome-Wide Interaction Models Using the Proteochemometrics ApproachHelena Strömbergsson, Maris Lapins, Gerard J Kleywegt, et al.
Molecular Informatics|July 28, 2016
Quantum Semiempirical Energy Based (SEEB) Descriptors Performance with Benzamidine Inhibitors of TrypsinAlexandre R F Carvalho, André Melo
Molecular Informatics|July 28, 2016
Characterization of Mixtures. Part 2: QSPR Models for Prediction of Excess Molar Volume and Liquid Density Using Neural NetworksSubhash Ajmani, Stephen C Rogers, Mark H Barley, et al.
Molecular Informatics|July 28, 2016
Support Vector Machine (SVM) as Alternative Tool to Assign Acute Aquatic Toxicity Warning Labels to ChemicalsLisa Michielan, Luca Pireddu, Matteo Floris, et al.
Molecular Informatics|July 28, 2016
Attractors in Sequence Space: Agent-Based Exploration of MHC I Binding PeptidesNatalie Jäger, Joanna M Wisniewska, Jan A Hiss, et al.
Molecular Informatics|July 28, 2016
Forecasting CYP2D6 and CYP3A4 Risk with a Global/Local Fusion Model of CYP450 InhibitionTodd Ewing, Miklos Feher
Molecular Informatics|July 28, 2016
Predicting the Flexibility Profile of Ribosomal RNAsFeifei Tian, Chun Zhang, Xia Fan, et al.
Molecular Informatics|July 28, 2016
An Improved Weighted-Residue Profile Based Method of Using Protein-Ligand Interaction Information in Increasing Hits Selection from Virtual Screening: A Study on Virtual Screening of Human GPCR A2A Receptor AntagonistsMohammad Shahid, Vinod Kasam, Martin Hofmann-Apitius
Molecular Informatics|July 28, 2016
Consensus QSAR Related to Global or MOA Models: Application to Acute Toxicity for FishSylvain Lozano, Marie-Pierre Halm-Lemeille, Alban Lepailleur, et al.
Molecular Informatics|July 29, 2016
Retrospective Mapping of SAR Data for TTR Protein in Chemico-Biological Space Using Ligand Efficiency Indices as a Guide to Drug Discovery StrategiesDaniel Blasi, Gemma Arsequell, Gregori Valencia, et al.
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