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Molecular Informatics|August 23, 2016
How to Choose the Suitable Template for Homology Modelling of GPCRs: 5-HT7 Receptor as a Test CaseNir Shahaf, Matteo Pappalardo, Livia Basile, et al.
Molecular Informatics|August 23, 2016
Structural Effects of Some Relevant Missense Mutations on the MECP2-DNA Binding: A MD Study Analyzed by Rescore+, a Versatile Rescoring Tool of the VEGA ZZ ProgramAlessandro Pedretti, Cinzia Granito, Angelica Mazzolari, et al.
Molecular Informatics|August 23, 2016
New Trends in Inspecting GPCR-ligand Recognition Process: the Contribution of the Molecular Modeling Section (MMS) at the University of PadovaAntonella Ciancetta, Alberto Cuzzolin, Giuseppe Deganutti, et al.
Molecular Informatics|May 28, 2019
Molecular Modelling of Potential Candidates for the Treatment of DepressionDaniela Rodrigues Silva, Stephen J Barigye, Letícia Santos-Garcia, et al.
Molecular Informatics|November 27, 2018
Gaussian Process Regression Models for the Prediction of Hydrogen Bond Acceptor StrengthsChristoph A Bauer, Gisbert Schneider, Andreas H Göller
Molecular Informatics|December 13, 2019
MUBD-DecoyMaker 2.0: A Python GUI Application to Generate Maximal Unbiased Benchmarking Data Sets for Virtual Drug ScreeningJie Xia, Shan Li, Yu Ding, et al.
Molecular Informatics|December 17, 2019
iQSPR in XenonPy: A Bayesian Molecular Design AlgorithmStephen Wu, Guillaume Lambard, Chang Liu, et al.
Molecular Informatics|May 16, 2022
Translating from Proteins to Ribonucleic Acids for Ligand-binding Site DetectionLukas Möller, Lorenzo Guerci, Clemens Isert, et al.
Molecular Informatics|February 21, 2020
Deciphering Imidazoline Off-targets by Fishing in the Class A of GPCR fieldTeodora Djikic, Jelica Vucicevic, Jonne Laurila, et al.
Molecular Informatics|February 29, 2020
Using Machine Learning Methods and Structural Alerts for Prediction of Mitochondrial ToxicityJennifer Hemmerich, Florentina Troger, Barbara Füzi, et al.
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