Ultrafast structural changes within a photosynthetic reaction centre

The primary structural photoresponse of phytochrome proteins captured by a femtosecond X-ray laser

(2020) Elin Claesson et al.   eLife

A tool for visualizing protein motions in time-resolved crystallography

(2020) Cecilia Wickstrand et al.   Structural Dynamics-US

Optimized noise reduction scheme for heterodyne spectroscopy using array detectors

(2019) Yuan Feng et al.   OPTICS EXPRESS

Three-dimensional view of ultrafast dynamics in photoexcited bacteriorhodopsin

(2019) Gabriela Nass Kovacs et al.   Nature Communications

An oxyl/oxo mechanism for oxygen-oxygen coupling in PSII revealed by an x-ray free-electron laser

(2019) Michihiro Suga et al.   SCIENCE

Retinal isomerization in bacteriorhodopsin captured by a femtosecond x-ray laser

(2018) Przemyslaw Nogly et al.   SCIENCE

Structures of the intermediates of Kok’s photosynthetic water oxidation clock

(2018) Jan Kern et al.   NATURE

Light-induced structural changes and the site of O=O bond formation in PSII caught by XFEL

(2017) Michihiro Suga et al.   NATURE

Chromophore twisting in the excited state of a photoswitchable fluorescent protein captured by time-resolved serial femtosecond crystallography

(2017) Nicolas Coquelle et al.   Nature Chemistry

General noise suppression scheme with reference detection in heterodyne nonlinear spectroscopy

(2017) Yuan Feng et al.   OPTICS EXPRESS

Analysis of the Electronic Structure of the Special Pair of a Bacterial Photosynthetic Reaction Center by 13 C Photochemically Induced Dynamic Nuclear Polarization Magic-Angle Spinning NMR Using a Double-Quantum Axis

(2017) Marija Najdanova et al.   PHOTOCHEMISTRY AND PHOTOBIOLOGY

From Macrocrystals to Microcrystals: A Strategy for Membrane Protein Serial Crystallography

(2017) Robert Dods et al.   STRUCTURE

Structure of photosystem II and substrate binding at room temperature

(2016) Iris D. Young et al.   NATURE

Electric-field-stimulated protein mechanics

(2016) Doeke R. Hekstra et al.   NATURE

Femtosecond structural dynamics drives the trans/cis isomerization in photoactive yellow protein

(2016) K. Pande et al.   SCIENCE

Recent developments inCrystFEL

(2016) Thomas A. White et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Bacteriorhodopsin: Would the real structural intermediates please stand up?

(2015) Cecilia Wickstrand et al.   BIOCHIMICA ET BIOPHYSICA ACTA-GENERAL SUBJECTS

Direct observation of ultrafast collective motions in CO myoglobin upon ligand dissociation

(2015) T. R. M. Barends et al.   SCIENCE

The Coherent X-ray Imaging instrument at the Linac Coherent Light Source

(2015) Mengning Liang et al.   JOURNAL OF SYNCHROTRON RADIATION

Visualizing a protein quake with time-resolved X-ray scattering at a free-electron laser

(2014) David Arnlund et al.   NATURE METHODS

Time-resolved serial crystallography captures high-resolution intermediates of photoactive yellow protein

(2014) Jason Tenboer et al.   SCIENCE

Cheetah: software for high-throughput reduction and analysis of serial femtosecond X-ray diffraction data

(2014) Anton Barty et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit

(2013) Sander Pronk et al.   BIOINFORMATICS

Achieving few-femtosecond time-sorting at hard X-ray free-electron lasers

(2013) M. Harmand et al.   Nature Photonics

Protein dynamics to optimize and control bacterial photosynthesis

(2013) David N. LeBard et al.   Chemical Science

Deformation of Chlorin Rings in the Photosystem II Crystal Structure

(2012) Keisuke Saito et al.   BIOCHEMISTRY

CrystFEL: a software suite for snapshot serial crystallography

(2012) Thomas A. White et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Generating Efficient Quantum Chemistry Codes for Novel Architectures

(2012) Alexey V. Titov et al.   Journal of Chemical Theory and Computation

PHENIX: a comprehensive Python-based system for macromolecular structure solution

(2010) Paul D. Adams et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

First lasing and operation of an ångstrom-wavelength free-electron laser

(2010) P. Emma et al.   Nature Photonics

Light-Induced Structural Changes in a Photosynthetic Reaction Center Caught by Laue Diffraction

(2010) A. B. Wohri et al.   SCIENCE

MolProbity: all-atom structure validation for macromolecular crystallography

(2009) Vincent B. Chen et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

Lipidic Sponge Phase Crystal Structure of a Photosynthetic Reaction Center Reveals Lipids on the Protein Surface

(2009) Annemarie B. Wöhri et al.   BIOCHEMISTRY

Quantum Chemistry on Graphical Processing Units. 3. Analytical Energy Gradients, Geometry Optimization, and First Principles Molecular Dynamics

(2009) Ivan S. Ufimtsev et al.   Journal of Chemical Theory and Computation

Identification of the First Steps in Charge Separation in Bacterial Photosynthetic Reaction Centers of Rhodobacter sphaeroides by Ultrafast Mid-Infrared Spectroscopy: Electron Transfer and Protein Dynamics

(2008) Natalia P. Pawlowicz et al.   BIOPHYSICAL JOURNAL

Gas dynamic virtual nozzle for generation of microscopic droplet streams

(2008) D P DePonte et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS