Rolling the Quantum Dice: Challenging the Hilbert with Monte Carlo Trace Sampling
ErCry4a is likely not genetically optimised to truncate spin relaxation
Critical differences in the allosteric network of GC-E unveiled
The crucial role of receptor models in tick-borne encephalitis therapy unraveled
A roadmap paper reviews studies on solid-state systems exposed to radiation
Enlightening the absorption scheme of proteins
Cryptochrome 4 may be involved in atlantic herring magnetoreception
Conformational changes in pigeon cryptochrome described through coarse grained simulations.
Studying the impact of melittin on Gram-Negative Bacteria Outer Membrane
Some night-migratory songbirds have lost the potential magnetoreceptor
Flexibility directs charge transfer properties
Hydrogen and deuterium scrambling described in glycopeptides
Efficient virtual drug screening is now possible with ALISE
Primary electron transfers in robin cryptochrome revealed
Determining the upper bound for radiofrequency field effects
Use similarity measures to compare biological data
Accounting for spin relaxation effects now possible with MolSpin
Estimating the "half-field" parameter of cryptochrome
Motions in Plant and Avian Cryptochromes Influencing Compass Sensitivity Revealed
Different cryptochromes share similar energetics
Unfolding the folding mechanism of polypeptides
Stochastic dynamics simulations now possible in MBN Explorer
Feel the swing: Activation through motion.
Nanoinclusions can significantly change local elasticity of polymers
Avian magnetic compass disrupted by 80 MHz radiofrequency fields
Ion-induced shock waves lead to fatal DNA damage
Cryptochrome magnetoreception: four tryptophans could be better than three
A magnetically sensitive protein that could aid navigation in migratory birds found
Evidence for superoxide production in the mitochondrial bc1 complex
Antimalarial drugs target the cytochrome bc1 complex
Enhancement of cryptochrome compass sensitivity by nuclear polarization retention is Limited
Introducing Pep McConst—A user‐friendly peptide modeler for biophysical applications
Proton-coupled electron transfer reaction in the bc1 complex described
Multiscale simulation of the focused electron beam induced deposition process
Modeling the effect of ion-induced shock waves and DNA breakage with the reactive CHARMM force field
Collision cross-sections of a carbon ion with nucleotides established through quantum mechanical simulations
Key residues block FAD binding pocket in some cryptochromes
Possible binding of amino acids to graphene revealed through computations
VIKING enables an easy dive into multiscale modeling
Computational characterization of O2 binding in proteins made possible
Powerful software for modeling spin dynamics available
Graphene foam holds promise for tissue engineering applications
Modelling polymer elasticity through computations
Can radiowaves affect our cells?
Modeling MesoBioNano systems with MBN Studio made easy
Cryptochrome4 from European robin seeks an interaction partner
Conformational dynamics of cryptochrome 4 revealed
Diffusing MRE11 finds damaged DNA sites
FAD photoabsorption fails to explain green-light magnetoreception
Carbon ion ejects an electron cloud upon collision with nucleotides
Cryptochrome supports failsafe electron transfer mechanism
Cryptochrome 4 localizes in the double-cones of migratory birds
Unlikely involvement of ascorbate in magnetoreception
Computational reconstruction debunks ISCA1 compass needle
Binding mechanism for enzymes capable of repairing DNA damaged by sunlight
O2 becomes superoxide in the BC1 complex
O2 binding sites in bc1 complex mutants revealed
Molecular oxygen migrates into the Qo-site of the bc1 complex
Isolated plant cryptochrome is a poor magnetoreceptor
Reactive force field in MBN Explorer available
Polarizabilities are key for accurate electron transfer simulations
Solvent drives electrons in plant cryptochrome
Quinol binding modes in the bc1 complex identified
Parallel 3D kinetic Monte Carlo method available
Photochemistry of cryptochrome decrypted through computations
