Related references
Note: Only part of the references are listed.Mass Spectrometry of Nucleic Acid Noncovalent Complexes
Eric Largy et al.
CHEMICAL REVIEWS (2022)
High-Resolution Native Mass Spectrometry
Sem Tamara et al.
CHEMICAL REVIEWS (2022)
Sizing up DNA nanostructure assembly with native mass spectrometry and ion mobility
Jeroen F. van Dyck et al.
NATURE COMMUNICATIONS (2022)
Expanding the boundaries of ligand-target modeling by exascale calculations
Viacheslav Bolnykh et al.
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2021)
Protein Footprinting: Auxiliary Engine to Power the Structural Biology Revolution
Mark R. Chance et al.
JOURNAL OF MOLECULAR BIOLOGY (2020)
CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations
Thomas D. Kuehne et al.
JOURNAL OF CHEMICAL PHYSICS (2020)
Native mass spectrometry-A valuable tool in structural biology
Marie Barth et al.
JOURNAL OF MASS SPECTROMETRY (2020)
MiMiC: A Novel Framework for Multiscale Modeling in Computational Chemistry
Jogvan Magnus Haugaard Olsen et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2019)
Promoting transparency and reproducibility in enhanced molecular simulations
Massimiliano Bonomi et al.
NATURE METHODS (2019)
Extreme Scalability of DFT-Based QM/MM MD Simulations Using MiMiC
Viacheslav Bolnykh et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2019)
Native Mass Spectrometry: What is in the Name?
Aneika C. Leney et al.
JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY (2017)
Compaction of Duplex Nucleic Acids upon Native Electrospray Mass Spectrometry
Massimiliano Porrini et al.
ACS CENTRAL SCIENCE (2017)
Parmbsc1: a refined force field for DNA simulations
Ivan Ivani et al.
NATURE METHODS (2016)
Exploring the Mechanism of Salt-Induced Signal Suppression in Protein Electrospray Mass Spectrometry Using Experiments and Molecular Dynamics Simulations
Haidy Metwally et al.
ANALYTICAL CHEMISTRY (2015)
Structure and Dynamics of Oligonucleotides in the Gas Phase
Annalisa Arcella et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2015)
PLUMED 2: New feathers for an old bird
Gareth A. Tribello et al.
COMPUTER PHYSICS COMMUNICATIONS (2014)
Unraveling the Mechanism of Electrospray Ionization
Lars Konermann et al.
ANALYTICAL CHEMISTRY (2013)
Structure of Triplex DNA in the Gas Phase
Annalisa Arcella et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
Effect of the Damping Function in Dispersion Corrected Density Functional Theory
Stefan Grimme et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2011)
RED Server: a web service for deriving RESP and ESP charges and building force field libraries for new molecules and molecular fragments
Enguerran Vanquelef et al.
NUCLEIC ACIDS RESEARCH (2011)
Multiple Routes to Characterize the Folding of a Small DNA Hairpin
Guillem Portella et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2010)
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
Stefan Grimme et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
DNA Hairpin, Pseudoknot, and Cruciform Stability in a Solvent-Free Environment
Erin Shammel Baker et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Gaussian basis sets for accurate calculations on molecular systems in gas and condensed phases
Joost VandeVondele et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Canonical sampling through velocity rescaling
Giovanni Bussi et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
An efficient linear-scaling electrostatic coupling for treating periodic boundary conditions in QM/MM simulations
Teodoro Laino et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2006)
G-quadruplexes can maintain their structure in the gas phase
M Rueda et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
An efficient real space multigrid OM/MM electrostatic coupling
T Laino et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2005)
The structure and dynamics of DNA in the gas phase
M Rueda et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
Refinement of d(GCGAAGC) hairpin structure using one- and two-bond residual dipolar couplings
P Padrta et al.
JOURNAL OF BIOMOLECULAR NMR (2002)
Share Paper
