Efficient anharmonic vibrational spectroscopy for large molecules using local-mode coordinates X Cheng, RP Steele The Journal of Chemical Physics 141 (10), 2014 | 125 | 2014 |
Monitoring water clusters “melt” through vibrational spectroscopy SE Brown, AW Götz, X Cheng, RP Steele, VA Mandelshtam, F Paesani Journal of the American Chemical Society 139 (20), 7082-7088, 2017 | 92 | 2017 |
Tuning vibrational mode localization with frequency windowing X Cheng, JJ Talbot, RP Steele The Journal of Chemical Physics 145 (12), 2016 | 58 | 2016 |
Vibrational Signatures of Conformer-Specific Intramolecular Interactions in Protonated Tryptophan AY Pereverzev, X Cheng, NS Nagornova, DL Reese, RP Steele, ... The Journal of Physical Chemistry A 120 (28), 5598-5608, 2016 | 38 | 2016 |
Dynamic modulation of the lipid translocation groove generates a conductive ion channel in Ca2+-bound nhTMEM16 G Khelashvili, ME Falzone, X Cheng, BC Lee, A Accardi, H Weinstein Nature communications 10 (1), 4972, 2019 | 26 | 2019 |
TMEM16 scramblases thin the membrane to enable lipid scrambling ME Falzone, Z Feng, OE Alvarenga, Y Pan, BC Lee, X Cheng, E Fortea, ... Nature communications 13 (1), 2604, 2022 | 24 | 2022 |
Vibrational signatures of electronic properties in oxidized water: unraveling the anomalous spectrum of the water dimer cation JJ Talbot, X Cheng, JD Herr, RP Steele Journal of the American Chemical Society 138 (36), 11936-11945, 2016 | 23 | 2016 |
Accelerating Ab Initio Path Integral Simulations via Imaginary Multiple-Timestepping X Cheng, JD Herr, RP Steele Journal of chemical theory and computation 12 (4), 1627-1638, 2016 | 17 | 2016 |
Membrane lipids are both the substrates and a mechanistically responsive environment of TMEM16 scramblase proteins G Khelashvili, X Cheng, ME Falzone, M Doktorova, A Accardi, ... Journal of computational chemistry 41 (6), 538-551, 2020 | 15 | 2020 |
Variational mixed quantum/semiclassical simulation of dihalogen guest and rare-gas solid host dynamics X Cheng, JA Cina The Journal of Chemical Physics 141 (3), 2014 | 13 | 2014 |
Numerical tests of a fixed vibrational basis/Gaussian bath theory for small molecule dynamics in low-temperature media CT Chapman, X Cheng, JA Cina The Journal of Physical Chemistry A 115 (16), 3980-3989, 2011 | 10 | 2011 |
The allosteric mechanism leading to an open-groove lipid conductive state of the TMEM16F scramblase G Khelashvili, E Kots, X Cheng, MV Levine, H Weinstein Communications Biology 5 (1), 990, 2022 | 8 | 2022 |
The permeation of potassium ions through the lipid scrambling path of the membrane protein nhTMEM16 X Cheng, G Khelashvili, H Weinstein Frontiers in Molecular Biosciences 9, 903972, 2022 | 3 | 2022 |
Mixed quantum/semiclassical theory for small-molecule dynamics and spectroscopy in low-temperature solids X Cheng University of Oregon, 2013 | 2 | 2013 |
Structural Basis of Lipid Scrambling and Ion Conduction by TMEM16 Scramblases A Accardi, M Falzone, BC Lee, X Cheng, G Khelashvili, H Weinstein The FASEB Journal 34 (S1), 1-1, 2020 | | 2020 |
A Partially Closed State in Nhtmem16 Scramblase is Enabled by Lipid Tail Insertion into the Protein Groove G Khelashvili, M Falzone, X Cheng, A Accardi, H Weinstein Biophysical Journal 116 (3), 374a, 2019 | | 2019 |
Anharmonic vibrational spectroscopy calculations of large molecules X Cheng, R Steele ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |
New approaches to anharmonic vibrational spectroscopy in large molecules X Cheng, RP Steele ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 248, 2014 | | 2014 |
Beyond vibrational dissipation and decoherence. A mixed quantum/semiclassical theory for small-molecule and host-lattice dynamics in low-temperature media. C Chapman, X Cheng, J Cina APS March Meeting Abstracts 2010, Y28. 010, 2010 | | 2010 |
Semiclassical Treatment for Small-Molecule Dynamics in Low-Temperature Crystals Using a Fixed Vibrational Basis and Gaussian Bath Wave Packets X Cheng, C Chapman, J Cina APS March Meeting Abstracts 2010, K1. 268, 2010 | | 2010 |