Author: bugman Date: Fri Nov 8 11:09:31 2013 New Revision: 21405 URL: http://svn.gna.org/viewcvs/relax?rev=21405&view=rev Log: Added the TAP03 model to the dispersion chapter of the user manual. Modified: branches/relax_disp/docs/latex/bibliography.bib branches/relax_disp/docs/latex/dispersion.tex branches/relax_disp/docs/latex/dispersion_models.tex branches/relax_disp/docs/latex/dispersion_software.tex Modified: branches/relax_disp/docs/latex/bibliography.bib URL: http://svn.gna.org/viewcvs/relax/branches/relax_disp/docs/latex/bibliography.bib?rev=21405&r1=21404&r2=21405&view=diff ============================================================================== --- branches/relax_disp/docs/latex/bibliography.bib (original) +++ branches/relax_disp/docs/latex/bibliography.bib Fri Nov 8 11:09:31 2013 @@ -72,6 +72,9 @@ % Mathematics of Computation. @STRING{mc = "Math. Comp."} + +% Molecular Physics. +@STRING{mp = "Mol. Phys."} % Physical Review. @STRING{physrev = "Phys. Rev."} @@ -6887,6 +6890,51 @@ year = 2001 } +@Article{Trott03, + Author = {Trott, O and Abergel, D and Palmer, AG}, + Title = {An average-magnetization analysis of {R}-1 rho + relaxation outside of the fast exchange}, + Journal = mp, + Volume = {101}, + Number = {6}, + Pages = {753-763}, + abstract = {Approximate expressions for the {NMR} spin relaxation + rate constant in the rotating frame of reference {R}-1rho + are derived for two-site chemical exchange by + consideration of the evolution of the average density + operator using the stochastic {L}iouville equation. + {R}-1rho is obtained as a linearized approximation to the + largest (least negative) eigenvalue of the matrix + describing the evolution of the average density + operator in the long-term limit. The expressions + obtained are more accurate than existing expressions + when exchange is not fast and the populations of the + exchanging sites are close to equal. The new + expressions for {R}-1rho facilitate the interpretation of + chemical exchange phenomena in proteins and other + biological macromolecules.}, + address = {4 PARK SQUARE, MILTON PARK, ABINGDON OX14 4RN, OXON, + ENGLAND}, + affiliation = {Abergel, D (Reprint Author), Ecole Normale Super, + Chim Lab, F-75005 Paris, France. Ecole Normale Super, + Chim Lab, F-75005 Paris, France. Columbia Univ, Dept + Biochem \& Mol Biophys, New York, NY 10032 USA.}, + doc-delivery-number = {660MA}, + doi = {10.1080/0026897021000054826}, + issn = {0026-8976}, + journal-iso = {Mol. Phys.}, + keywords-plus = {SPIN}, + language = {English}, + number-of-cited-references = {19}, + publisher = {TAYLOR \& FRANCIS LTD}, + research-areas = {Physics}, + times-cited = {18}, + type = {Article}, + unique-id = {ISI:000181835900005}, + web-of-science-categories = {Physics, Atomic, Molecular \& Chemical}, + year = 2003 +} + @Article{TrottPalmer02, Author = {Trott, O. and Palmer, 3rd, A. G.}, Title = {R1rho relaxation outside of the fast-exchange limit.}, Modified: branches/relax_disp/docs/latex/dispersion.tex URL: http://svn.gna.org/viewcvs/relax/branches/relax_disp/docs/latex/dispersion.tex?rev=21405&r1=21404&r2=21405&view=diff ============================================================================== --- branches/relax_disp/docs/latex/dispersion.tex (original) +++ branches/relax_disp/docs/latex/dispersion.tex Fri Nov 8 11:09:31 2013 @@ -837,6 +837,7 @@ Some of the missing models include: \begin{description} +\item[`TAP03':]\index{relaxation dispersion!TAP03 model} The $\Ronerho$-type data \citet{Trott03} 2-site analytic equation for all time scales with parameters $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$. \item[`TP04':]\index{relaxation dispersion!TP04 model} The $\Ronerho$-type data \citet{TrottPalmer04} N-site analytic equation for all time scales with parameters $\{\Ronerhoprime, \dots, \pone, \dots, \pN, \aveomega, \konetwo, \dots\, \koneN\}$. \item[`MP05':]\index{relaxation dispersion!TP04 model} The $\Ronerho$-type data \citet{MiloushevPalmer05} 2-site analytic equation for all time scales with parameters $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$. \item[`MMQ 3-site linear':]\index{relaxation dispersion!MMQ 3-site linear model} The model of the numeric solution for linear 3-site exchange for combined proton-heteronuclear SQ, ZQ, DQ and MQ (MMQ) CPMG-type data. Modified: branches/relax_disp/docs/latex/dispersion_models.tex URL: http://svn.gna.org/viewcvs/relax/branches/relax_disp/docs/latex/dispersion_models.tex?rev=21405&r1=21404&r2=21405&view=diff ============================================================================== --- branches/relax_disp/docs/latex/dispersion_models.tex (original) +++ branches/relax_disp/docs/latex/dispersion_models.tex Fri Nov 8 11:09:31 2013 @@ -77,6 +77,7 @@ DPL94 & Analytic & 2 & $\{\Ronerhoprime, \dots, \Phiex, \kex\}$ & Fast exchange & \citet{Davis94} \\ M61 skew & Analytic & 2 & $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$ & $\pA \gg \pB$, on-resonance & \citet{Meiboom61} \\ TP02 & Analytic & 2 & $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$ & Not fast exchange & \citet{TrottPalmer02} \\ +TAP03\footnotemark[1] & Analytic & 2 & $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$ & $\pA > \pB$ & \citet{Trott03} \\ TP04\footnotemark[1] & Analytic & N & $\{\Ronerhoprime, \dots, \pone, \dots, \pN, \aveomega, \konetwo, \dots\, \koneN\}$ & One site dominant & \citet{TrottPalmer04} \\ MP05\footnotemark[1] & Analytic & 2 & $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$ & $\pA > \pB$ & \citet{MiloushevPalmer05} \\ NS R1rho 2-site & Numeric & 2 & $\{\Ronerhoprime, \dots, \pA, \dw, \kex\}$ & $\pA > \pB$ & - \\ Modified: branches/relax_disp/docs/latex/dispersion_software.tex URL: http://svn.gna.org/viewcvs/relax/branches/relax_disp/docs/latex/dispersion_software.tex?rev=21405&r1=21404&r2=21405&view=diff ============================================================================== --- branches/relax_disp/docs/latex/dispersion_software.tex (original) +++ branches/relax_disp/docs/latex/dispersion_software.tex Fri Nov 8 11:09:31 2013 @@ -66,6 +66,7 @@ M61 & \no & \no & \no & \no & \no & \no & \no & \no & \yes \\ DPL94 & \no & \no & \no & \no & \no & \no & \no & \no & \yes \\ TP02 & \no & \yes & \no & \no & \no & \no & \no & \no & \yes \\ +TAP03 & \no & \no & \no & \no & \no & \no & \no & \no & \no \\ TP04 & \no & \no & \no & \no & \no & \no & \no & \no & \no \\ MP05 & \no & \no & \no & \no & \no & \no & \no & \no & \no \\ NS 2-site & \no & \yes & \no & \no & \no & \no & ? & \no & \yes \\