Error estimates in the determination of rigid body displacements in protein crystals

We report the estimation of random errors in the refinement of the rigid body displacements of the -helices of the enzyme 6-phosphogluconate dehydrogenase. Least-squares refinement of the TLS parameters of the helices has been carried out using X-ray reflection data of 2.1 Å resolution, resulting in anR-factor of 19.5%. Standard deviations were estimated from the normal matrix. The results show that the translational mean-square displacements of nearly all the helices are significant at this resolution. However the libration parameters are only significant when the helices have at least four turns. Screw-rotation tensor values cannot be determined at this resolution.     

Conformally invariant powers of the Laplacian -- A complete nonexistence theorem

We show that on conformal manifolds of even dimension there is no conformally invariant natural differential operator between density bundles with leading part a power of the Laplacian for n/2$">. This shows that a large class of invariant operators on conformally flat manifolds do not generalise to arbitrarily curved manifolds and that the theorem of Graham, Jenne, Mason and Sparling, asserting the existence of curved version of for , is sharp.

     

Conformal Operators on Weighted Forms; Their Decomposition and Null Space on Einstein Manifolds

There is a class of Laplacian like conformally invariant differential operators on differential forms ${L^\ell_k}$ which may be considered as the generalisation to differential forms of the conformally invariant powers of the Laplacian known as the Paneitz and GJMS operators. On conformally Einstein manifolds we give explicit formulae for these as factored polynomials in second-order differential operators. In the case that the manifold is not Ricci flat we use this to provide a direct sum decomposition of the null space of the ${L^\ell_k}$ in terms of the null spaces of mutually commuting second-order factors.     

Conformally Invariant Operators,Differential Forms,Cohomology and a Generalisation of Q-Curvature

On conformal manifolds of even dimension n ≥ 4 we construct a family of new conformally invariant differential complexes, each containing one coboundary operator of order greater than 1. Each bundle in each of these complexes appears either in the de Rham complex or in its dual (which is a different complex in the non-orientable case). Each of the new complexes is elliptic in case the conformal structure has Riemannian signature. We also construct gauge companion operators which (for differential forms of order k ≤ n/2) complete the exterior derivative to a conformally invariant and (in the case of Riemannian signature) elliptically coercive system. These (operator, gauge) pairs are used to define finite dimensional conformally stable form subspaces which are are candidates for spaces of conformal harmonics. This generalizes the n/2-form and 0-form cases, in which the harmonics are given by conformally invariant systems. These constructions are based on a family of operators on closed forms which generalize in a natural way Branson's Q-curvature. We give a universal construction of these new operators and show that they yield new conformally invariant global pairings between differential form bundles. Finally we give a geometric construction of a family of conformally invariant differential operators between density-valued differential form bundles and develop their properties (including their ellipticity type in the case of definite conformal signature). The construction is based on the ambient metric of Fefferman and Graham, and its relationship to the tractor bundles for the Cartan normal conformal connection. For each form order, our derivation yields an operator of every even order in odd dimensions, and even order operators up to order n in even dimension n. In the case of unweighted (or true) forms as domain, these operators are the natural form analogues of the critical order conformal Laplacian of Graham et al., and are key ingredients in the new differential complexes mentioned above.     

Conformal Operators on Forms and Detour Complexes on Einstein Manifolds

For even dimensional conformal manifolds several new conformally invariant objects were found recently: invariant differential complexes related to, but distinct from, the de Rham complex (these are elliptic in the case of Riemannian signature); the cohomology spaces of these; conformally stable form spaces that we may view as spaces of conformal harmonics; operators that generalise Branson’s Q-curvature; global pairings between differential form bundles that descend to cohomology pairings. Here we show that these operators, spaces, and the theory underlying them, simplify significantly on conformally Einstein manifolds. We give explicit formulae for all the operators concerned. The null spaces for these, the conformal harmonics, and the cohomology spaces are expressed explicitly in terms of direct sums of subspaces of eigenspaces of the form Laplacian. For the case of non-Ricci flat spaces this applies in all signatures and without topological restrictions. In the case of Riemannian signature and compact manifolds, this leads to new results on the global invariant pairings, including for the integral of Q-curvature against the null space of the dimensional order conformal Laplacian of Graham et al.     

Yang-Mills Detour Complexes and Conformal Geometry

Working over a pseudo-Riemannian manifold, for each vector bundle with connection we construct a sequence of three differential operators which is a complex (termed a Yang-Mills detour complex) if and only if the connection satisfies the full Yang-Mills equations. A special case is a complex controlling the deformation theory of Yang-Mills connections. In the case of Riemannian signature the complex is elliptic. If the connection respects a metric on the bundle then the complex is formally self-adjoint. In dimension 4 the complex is conformally invariant and generalises, to the full Yang-Mills setting, the composition of (two operator) Yang-Mills complexes for (anti-)self-dual Yang-Mills connections. Via a prolonged system and tractor connection a diagram of differential operators is constructed which, when commutative, generates differential complexes of natural operators from the Yang-Mills detour complex. In dimension 4 this construction is conformally invariant and is used to yield two new sequences of conformal operators which are complexes if and only if the Bach tensor vanishes everywhere. In Riemannian signature these complexes are elliptic. In one case the first operator is the twistor operator and in the other sequence it is the operator for Einstein scales. The sequences are detour sequences associated to certain Bernstein-Gelfand-Gelfand sequences.     

Tractors,mass, and Weyl invariance

Deser and Nepomechie established a relationship between masslessness and rigid conformal invariance by coupling to a background metric and demanding local Weyl invariance, a method which applies neither to massive theories nor theories which rely upon gauge invariances for masslessness. We extend this method to describe massive and gauge invariant theories using Weyl invariance. The key idea is to introduce a new scalar field which is constant when evaluated at the scale corresponding to the metric of physical interest. This technique relies on being able to efficiently construct Weyl invariant theories. This is achieved using tractor calculus—a mathematical machinery designed for the study of conformal geometry. From a physics standpoint, this amounts to arranging fields in multiplets with respect to the conformal group but with novel Weyl transformation laws. Our approach gives a mechanism for generating masses from Weyl weights. Breitenlohner–Freedman stability bounds for Anti-de Sitter theories arise naturally as do direct derivations of the novel Weyl invariant theories given by Deser and Nepomechie. In constant curvature spaces, partially massless theories—which rely on the interplay between mass and gauge invariance—are also generated by our method. Another simple consequence is conformal invariance of the maximal depth partially massless theories. Detailed examples for spins s?2$s?2$ are given including tractor and component actions, on-shell and off-shell approaches and gauge invariances. For all spins s?2$s?2$ we give tractor equations of motion unifying massive, massless, and partially massless theories.     

Standard Tractors and the Conformal Ambient Metric Construction

In this paper we relate the Fefferman–Graham ambientmetric construction for conformal manifolds to the approach toconformal geometry via the canonical Cartan connection. We show thatfrom any ambient metric that satisfies a weakening of the usualnormalisation condition, one can construct the conformal standardtractor bundle and the normal standard tractor connection, which areequivalent to the Cartan bundle and the Cartan connection. This resultis applied to obtain a procedure to get tractor formulae for allconformal invariants that can be obtained from the ambient metricconstruction. We also get information on ambient metrics whichare Ricci flat to higher order than guaranteed by the results ofFefferman–Graham.