S. Rodde

What is modulating solubility in simulated intestinal fluids?

Bernard Faller, Stephane Rodde, B. Faller, 2010, European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences.

Integrated and Automated High-Throughput Purification of Libraries on Microscale.

Jonathan E. Grob, T. Wagner, J. Reilly, 2022, SLAS technology.

Lessons for Oral Bioavailability: How Conformationally Flexible Cyclic Peptides Enter and Cross Lipid Membranes

Stephanie M. Linker, H. Roth, S. Riniker, 2023, Journal of medicinal chemistry.

Effect of Flexibility, Lipophilicity, and the Location of Polar Residues on the Passive Membrane Permeability of a Series of Cyclic Decapeptides.

H. Roth, S. Riniker, Shuzhe Wang, 2021, Journal of medicinal chemistry.

Prediction of pKa Using Machine Learning Methods with Rooted Topological Torsion Fingerprints: Application to Aliphatic Amines

Peter Gedeck, Brian Kelley, Weiping Jia, 2019, J. Chem. Inf. Model..

Polar/apolar interfaces modulate the conformational behavior of cyclic peptides with impact on their passive membrane permeability

Stephanie M. Linker, H. Roth, S. Riniker, 2022, RSC advances.

High accuracy quantum-chemistry-based calculation and blind prediction of macroscopic pKa values in the context of the SAMPL6 challenge

Stefan Grimme, Stephane Rodde, Rainer Wilcken, 2018, Journal of Computer-Aided Molecular Design.

Developing Collaborative QSAR Models Without Sharing Structures

Peter Gedeck, Stephane Rodde, Suzanne Skolnik, 2017, J. Chem. Inf. Model..

Strategies to Tackle the Waste Water from α-Tocopherol-Derived Surfactant Chemistry

R. Schreiber, M. Parmentier, F. Gallou, 2021 .

Quantitative and functional characterisation of extracellular vesicles after passive loading with hydrophobic or cholesterol-tagged small molecules.

S. Hintermann, C. Matea, C. Huber, 2023, Journal of controlled release : official journal of the Controlled Release Society.

ReSCoSS: a flexible quantum chemistry workflow identifying relevant solution conformers of drug-like molecules

R. Wilcken, A. Udvarhelyi, S. Rodde, 2020, Journal of Computer-Aided Molecular Design.

Benefit of Retraining pKa Models Studied Using Internally Measured Data

Peter Gedeck, Franco Lombardo, Weiping Jia, 2015, J. Chem. Inf. Model..