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Protein Science : a Publication of the Protein Society|July 1, 2014
A maximum entropy approach to the study of residue-specific backbone angle distributions in α-synuclein, an intrinsically disordered proteinAlexey B Mantsyzov, Alexander S Maltsev, Jinfa Ying, et al.Proceedings of the National Academy of Sciences of the United States of America|November 5, 2005
Cooperative water filling of a nonpolar protein cavity observed by high-pressure crystallography and simulationMarcus D Collins, Gerhard Hummer, Michael L Quillin, et al.Journal of Molecular Biology|February 13, 2007
Structural rigidity of a large cavity-containing protein revealed by high-pressure crystallographyMarcus D Collins, Michael L Quillin, Gerhard Hummer, et al.Proteins|December 10, 2016
Systematic evaluation of CS-Rosetta for membrane protein structure prediction with sparse NOE restraintsKatrin Reichel, Olivier Fisette, Tatjana Braun, et al.Journal of Medicinal Chemistry|October 22, 2025
A Chemically Induced CRISPR/dCas13FCPF Platform for Precise and Programmable RNA RegulationSebastian Hasselbeck, Jianhui Wang, Zhaodai Bai, et al.The Journal of Physical Chemistry Letters|August 8, 2022
Transition Rates and Efficiency of Collective Variables from Time-Dependent Biased SimulationsKaren Palacio-Rodriguez, Hadrien Vroylandt, Lukas S Stelzl, et al.Journal of Chemical Theory and Computation|July 7, 2015
Machine Learning of Parameters for Accurate Semiempirical Quantum Chemical CalculationsPavlo O Dral, O Anatole von Lilienfeld, Walter ThielTopics in Current Chemistry|April 22, 2015
Description of Conical Intersections with Density Functional MethodsMiquel Huix-Rotllant, Alexander Nikiforov, Walter Thiel, et al.Biophysical Journal|May 22, 2007
Quantum mechanics/molecular mechanics calculation of the Raman spectra of the phycocyanobilin chromophore in alpha-C-phycocyaninMaria Andrea Mroginski, Franz Mark, Walter Thiel, et al.Chemical Communications (Cambridge, England)|October 7, 2004
The mechanism of the oxidative addition of aryl halides to Pd-catalysts: a DFT investigationLukas J Goossen, Debasis Koley, Holger Hermann, et al.Pageof 59