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4 Jan 2016: the environment.24 This “tensor free”approach has been implemented using RDCs as restraints inreplica-averaged molecular dynamics simulations, whereaveraged observables over multiple replicas of a protein arerestrained with respect to

23 Jan 2016: et al. Chemistry 12, 2854–2865 (2006).24. Orozco, M. & Luque, F.J. ... Luque, F.J. J. Comput. Aided Mol. Des. 24,. 281–291 (2010).41.

23 Jan 2016: replicas as N2, that is, more than linearly, as required by the maximumentropy principle (24). ... J. Chem. Phys. 138, 094112 (2013). 24. B. Roux, J. Weare, On the statistical equivalence of restrained-ensemble simulations withthe maximum entropy method.

23 Jan 2016: We use the chemical shift information within the replica-averaged metadynamics (RAM) method,24 in which bias-exchange metadynamics is combined with a chemical shift-based penalty function implemented in the ... The side-chain χ1 torsion angle of the

23 Jan 2016: 2. 4. 8 Step 15: half-times. Step 31: global fitsStep 24: fitting algorithm.

4 Feb 2016: 23] A. Vitalis and R. V. Pappu, Biophys. Chem. 159, 14 (2011).[24] S.

12 Feb 2016: R E S E A R C H A R T I C L E. N E U R O SC I E N C E. 1Department of Chemistry, University of Cambridge, Cambridge CB2 1EW, UK. 2Universityof Groningen, University Medical Centre Groningen, European Research Institute for theBiology of Aging, 9700

15 Mar 2016: aggregation, change the Aβ42 oligomer conformation, and. attenuate Aβ42 oligomeric cytotoxicity.24,49. ... N.; Dunker, A. K. Rationaldrug design via intrinsically disordered protein. Trends Biotechnol.2006, 24, 435.(34) Metallo, S.

15 Mar 2016: Proc. Natl. Acad. Sci. USA 107, 8611–8616 (2010). 24. Radhakrishnan, I.

30 Apr 2016: ARTICLE. Received 24 Jul 2015 | Accepted 3 Feb 2016 | Published 24 Mar 2016. ... The globalfitting was performed by applying the set of equations reported in the Supplementary Equations 5–24.