Rafael Brüschweiler

发表

A covariance NMR toolbox for MATLAB and OCTAVE.

Timothy Short, Leigh Alzapiedi, Rafael Brüschweiler, 2011, Journal of magnetic resonance.

Quantitative computer simulations of biomolecules: A snapshot

Wei Yang, Rafael Brüschweiler, Huan-Xiang Zhou, 2008, J. Comput. Chem..

Decoding the Mobility and Time Scales of Protein Loops.

Rafael Brüschweiler, Da-Wei Li, Yina Gu, 2015, Journal of chemical theory and computation.

In Silico Elucidation of the Recognition Dynamics of Ubiquitin

Rafael Brüschweiler, Dong Long, R. Brüschweiler, 2011, PLoS Comput. Biol..

Statistical database analysis of the role of loop dynamics for protein‐protein complex formation and allostery

Rafael Brüschweiler, Da-Wei Li, Yina Gu, 2017, Bioinform..

TOCCATA: a customized carbon total correlation spectroscopy NMR metabolomics database.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2012, Analytical chemistry.

Entropy localization in proteins.

Rafael Brüschweiler, Da-Wei Li, R. Brüschweiler, 2010, The journal of physical chemistry. B.

In silico relationship between configurational entropy and soft degrees of freedom in proteins and peptides.

Rafael Brüschweiler, Da-Wei Li, R. Brüschweiler, 2009, Physical review letters.

Time-resolved observation of spin waves in a linear chain of nuclear spins

Rafael Brüschweiler, Richard R. Ernst, R. Brüschweiler, 1997 .

Contact model for the prediction of NMR N-H order parameters in globular proteins.

Rafael Brüschweiler, Fengli Zhang, 2002, Journal of the American Chemical Society.

Customized Metabolomics Database for the Analysis of NMR 1H–1H TOCSY and 13C–1H HSQC-TOCSY Spectra of Complex Mixtures

Rafael Brüschweiler, Da-Wei Li, R. Brüschweiler, 2014, Analytical chemistry.

Atomistic kinetic model for population shift and allostery in biomolecules.

Rafael Brüschweiler, Dong Long, R. Brüschweiler, 2011, Journal of the American Chemical Society.

Thermodynamic Interpretation of NMR Relaxation Parameters in Proteins in the Presence of Motional Correlations

Rafael Brüschweiler, Jeanine J. Prompers, R. Brüschweiler, 2000 .

Quantitative analysis of metabolic mixtures by two-dimensional 13C constant-time TOCSY NMR spectroscopy.

Rafael Brüschweiler, Fengli Zhang, Kerem Bingol, 2013, Analytical chemistry.

Characterization of biomolecular structure and dynamics by NMR cross relaxation

Rafael Brüschweiler, David A. Case, D. Case, 1994 .

NMR/MS Translator for the Enhanced Simultaneous Analysis of Metabolomics Mixtures by NMR Spectroscopy and Mass Spectrometry: Application to Human Urine.

Rafael Brüschweiler, R. Brüschweiler, Kerem Bingol, 2015, Journal of proteome research.

Self-consistent residual dipolar coupling based model-free analysis for the robust determination of nanosecond to microsecond protein dynamics

Oliver F. Lange, Jens Meiler, Axel Munk, 2008, Journal of biomolecular NMR.

High-resolution homonuclear 2D NMR of carbon-13 enriched metabolites and their mixtures.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2012, Journal of magnetic resonance.

Indirect covariance NMR spectroscopy.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2004, Journal of the American Chemical Society.

The future of NMR-based metabolomics.

Robert Powers, Daniel Raftery, Rafael Brüschweiler, 2017, Current opinion in biotechnology.

Theory of covariance nuclear magnetic resonance spectroscopy.

Rafael Brüschweiler, R. Brüschweiler, 2004, The Journal of chemical physics.

Deconvolution of chemical mixtures with high complexity by NMR consensus trace clustering.

Rafael Brüschweiler, R. Brüschweiler, Kerem Bingol, 2011, Analytical chemistry.

Contact model for the prediction of NMR N-H order parameters in globular proteins.

Rafael Brüschweiler, R. Brüschweiler, Fengli Zhang, 2002, Journal of the American Chemical Society.

Self-consistent metabolic mixture analysis by heteronuclear NMR. Application to a human cancer cell line.

Rafael Brüschweiler, Fengli Zhang, Steven L. Robinette, 2008, Analytical chemistry.

Web server based complex mixture analysis by NMR.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2008, Analytical chemistry.

Quantitative lid dynamics of MDM2 reveals differential ligand binding modes of the p53-binding cleft.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2008, Journal of the American Chemical Society.

Strategy for automated analysis of dynamic metabolic mixtures by NMR. Application to an insect venom.

Rafael Brüschweiler, Fengli Zhang, A. T. Dossey, 2007, Analytical chemistry.

Two elephants in the room: new hybrid nuclear magnetic resonance and mass spectrometry approaches for metabolomics

Rafael Brüschweiler, R. Brüschweiler, Kerem Bingol, 2015, Current opinion in clinical nutrition and metabolic care.

Web server suite for complex mixture analysis by covariance NMR

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2009, Magnetic resonance in chemistry : MRC.

Efficient RMSD measures for the comparison of two molecular ensembles

Rafael Brüschweiler, R. Brüschweiler, 2002, Proteins.

Simultaneous de novo identification of molecules in chemical mixtures by doubly indirect covariance NMR spectroscopy.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2010, Journal of the American Chemical Society.

All-atom contact model for understanding protein dynamics from crystallographic B-factors.

Rafael Brüschweiler, Da-Wei Li, R. Brüschweiler, 2009, Biophysical journal.

Identification of slow correlated motions in proteins using residual dipolar and hydrogen-bond scalar couplings.

Rafael Brüschweiler, Pau Bernadó, Martin Blackledge, 2005, Proceedings of the National Academy of Sciences of the United States of America.

NMR in Metabolomics and Natural Products Research: Two Sides of the Same Coin

Rafael Brüschweiler, Steven L. Robinette, Arthur S. Edison, 2011, Accounts of chemical research.

Self-consistency analysis of dipolar couplings in multiple alignments of ubiquitin.

Rafael Brüschweiler, Christian Griesinger, J. Hus, 2003, Journal of the American Chemical Society.

Protein conformational flexibility from structure-free analysis of NMR dipolar couplings: quantitative and absolute determination of backbone motion in ubiquitin.

Rafael Brüschweiler, Christian Griesinger, Martin Blackledge, 2009, Angewandte Chemie.

Maximal clique method for the automated analysis of NMR TOCSY spectra of complex mixtures

Rafael Brüschweiler, Da-Wei Li, R. Brüschweiler, 2017, Journal of biomolecular NMR.

Covariance NMR spectroscopy by singular value decomposition.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2004, Journal of magnetic resonance.

Principal component method for assessing structural heterogeneity across multiple alignment media

Rafael Brüschweiler, J. Hus, R. Brüschweiler, 2002, Journal of biomolecular NMR.

Arginine kinase: joint crystallographic and NMR RDC analyses link substrate-associated motions to intrinsic flexibility.

Rafael Brüschweiler, Michael S Chapman, M. S. Chapman, 2011, Journal of molecular biology.

Reorientational contact-weighted elastic network model for the prediction of protein dynamics: comparison with NMR relaxation.

Rafael Brüschweiler, Dengming Ming, R. Brüschweiler, 2006, Biophysical journal.

Improved Quantum Chemical NMR Chemical Shift Prediction of Metabolites in Aqueous Solution toward the Validation of Unknowns.

Rafael Brüschweiler, Daniel Sebastiani, Da-Wei Li, 2017, The journal of physical chemistry. A.

A dictionary for protein side-chain entropies from NMR order parameters.

Rafael Brüschweiler, Da-Wei Li, R. Brüschweiler, 2009, Journal of the American Chemical Society.

One- and two-dimensional ensemble quantum computing in spin Liouville space

Rafael Brüschweiler, Richard R. Ernst, R. Brüschweiler, 1998 .

Evaluation of configurational entropy methods from peptide folding-unfolding simulation.

Rafael Brüschweiler, Shuanghong Huo, Jinbu Wang, 2007, The journal of physical chemistry. B.

General framework for studying the dynamics of folded and nonfolded proteins by NMR relaxation spectroscopy and MD simulation.

Rafael Brüschweiler, Jeanine J Prompers, R. Brüschweiler, 2002, Journal of the American Chemical Society.

New approaches to the dynamic interpretation and prediction of NMR relaxation data from proteins.

Rafael Brüschweiler, R. Brüschweiler, 2003, Current opinion in structural biology.

Prediction of methyl-side Chain Dynamics in Proteins

Rafael Brüschweiler, Dengming Ming, R. Brüschweiler, 2004, Journal of biomolecular NMR.

Assignment strategy for proteins with known structure.

Rafael Brüschweiler, Jeanine J Prompers, J. Hus, 2002, Journal of magnetic resonance.

Metabolomics beyond spectroscopic databases: a combined MS/NMR strategy for the rapid identification of new metabolites in complex mixtures.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2015, Analytical chemistry.

Robust deconvolution of complex mixtures by covariance TOCSY spectroscopy.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2007, Angewandte Chemie.

Multidimensional approaches to NMR-based metabolomics.

Rafael Brüschweiler, R. Brüschweiler, Kerem Bingol, 2014, Analytical chemistry.

Model-free analysis of protein backbone motion from residual dipolar couplings.

Jens Meiler, Rafael Brüschweiler, Christian Griesinger, 2002, Journal of the American Chemical Society.

Unified and Isomer-Specific NMR Metabolomics Database for the Accurate Analysis of 13C–1H HSQC Spectra

Rafael Brüschweiler, Fengli Zhang, Da-Wei Li, 2014, ACS chemical biology.

Carbon backbone topology of the metabolome of a cell.

Rafael Brüschweiler, Fengli Zhang, R. Brüschweiler, 2012, Journal of the American Chemical Society.

Enhanced covariance spectroscopy from minimal datasets.

Rafael Brüschweiler, Fengli Zhang, Wolfgang Bermel, 2006, Journal of the American Chemical Society.

Knowns and unknowns in metabolomics identified by multidimensional NMR and hybrid MS/NMR methods.

Rafael Brüschweiler, R. Brüschweiler, Kerem Bingol, 2017, Current opinion in biotechnology.

Novel strategy for database searching in spin liouville space by NMR ensemble computing

Rafael Brüschweiler, 2000 .

LOCALLY ANISOTROPIC INTERNAL POLYPEPTIDE BACKBONE DYNAMICS BY NMR RELAXATION

Rafael Brüschweiler, R. Brüschweiler, T. Bremi, 1997 .

PPM_One: a static protein structure based chemical shift predictor

Rafael Brüschweiler, Dawei Li, 2015, Journal of biomolecular NMR.