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  • 1
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Acta crystallographica 55 (1999), S. 448-457 
    ISSN: 1399-0047
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Chemistry and Pharmacology , Geosciences , Physics
    Notes: The investigation of the structure of the four conformers of the nonapeptide described here has an additional purpose: to illustrate a method for combining isomorphous replacement information with anomalous dispersion information within the linear equations that have found use in the analysis of multiple-wavelength anomalous dispersion data. In the present application, isomorphous replacement data were obtained from the replacement of naturally occurring S atoms in the nonapeptide with Se atoms. Only one wavelength was used for the analysis: Cu Kα radiation. Details of the analysis are presented, as well as the structural results obtained. It was found that the four independent molecules in the structure have similar, but not identical, conformations. The backbones fold into predominantly α-helices with one or two 310-type hydrogen bonds and have extended side chains. Three to four water molecules are associated with each of the four head-to-tail regions between the peptides. Optimal packing between hydrophobic surfaces may account for the existence of four molecules in an asymmetric unit.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    [S.l.] : International Union of Crystallography (IUCr)
    Acta crystallographica 29 (1973), S. 702-710 
    ISSN: 1600-5724
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Chemistry and Pharmacology , Geosciences , Physics
    Notes: A procedure is described for optimizing the extraction of information from the diffraction data of a glass. A least-squares technique that minimizes the spurious detail in the radial distribution function (RDF) at small and large interatomic distances is employed both to isolate that portion of the total intensity function which contains the interatomic distance information and to remove from this function contributions from the shortest distances, thus eliminating the major source of termination errors. X-ray diffraction data for silica glass is utilized to illustrate the procedure. It is apparent that the procedure would be also applicable to the liquid state.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    [S.l.] : International Union of Crystallography (IUCr)
    Acta crystallographica 30 (1974), S. 679-679 
    ISSN: 1600-5724
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Chemistry and Pharmacology , Geosciences , Physics
    Notes: Corrections are given to equations (5), (6), (8) and (15) in the paper by Konnert & Karle [Acta Cryst. (1973). A29, 702-710].
    Type of Medium: Electronic Resource
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  • 4
    Electronic Resource
    Electronic Resource
    [S.l.] : International Union of Crystallography (IUCr)
    Acta crystallographica 36 (1980), S. 344-350 
    ISSN: 1600-5724
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Chemistry and Pharmacology , Geosciences , Physics
    Notes: Retention of known geometry, with regard to mean atomic positions, has proved useful in the refinement of macromolecules. In structures with a paucity of diffraction data and large displacements of the atoms from their mean positions, it is also of value to restrain the thermal factors to be consistent with known stereochemistry. This paper presents a technique for accomplishing this by restraining the variances of the interatomic distributions (which are functions of the mean atomic positions and the thermal parameters) to suitably small values. This procedure allows meaningful anisotropic refinement of macromolecules to be carried out with low-resolution diffraction data. Anisotropic thermal parameters obtained in this way should prove useful in understanding the dynamics of the biological functions of macromolecules.
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Acta crystallographica 22 (1967), S. 918-918 
    ISSN: 0001-5520
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences
    Type of Medium: Electronic Resource
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  • 6
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Acta crystallographica 50 (1994), S. 603-613 
    ISSN: 1399-0047
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Chemistry and Pharmacology , Geosciences , Physics
    Notes: The (110) faces of lysozyme crystals in their mother liquor have been investigated using an atomic force microscope (AFM) in height mode. Crystal growth and dissolution steps, as well as simultaneous growth and dissolution in pits, have been observed. Screw dislocations were also observed but the fine structure has not yet been investigated. Images that may possess molecular resolution were obtained and compared with theoretical images based on the crystallographic structure and the effects of arbitrary tip profiles. Crystallographic periodicities of 38 and 112 Å were observed. A recurring feature is a centered periodic array of minima that may be associated with one of the two nearly planar sheets of molecules present in the crystal that are parallel to the (110) faces.
    Type of Medium: Electronic Resource
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  • 7
    Electronic Resource
    Electronic Resource
    [S.l.] : International Union of Crystallography (IUCr)
    Acta crystallographica 32 (1976), S. 614-617 
    ISSN: 1600-5724
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Chemistry and Pharmacology , Geosciences , Physics
    Notes: A rapidly converging method for refining approximate atomic models is presented. It combines the conditional structure-factor least-squares procedure described by Waser [Acta Cryst. (1963). 16, 1091-1094] with the conjugate gradient method for solving linear systems [Hestenes & Stiefel, J. Res. Natl. Bur. Stand. (1952). 49, 409-436]. The method allows simultaneous variation of all of the structural parameters, although less than 1% of the derivative matrix need be calculated and stored for large systems and less than {{1}\over{64}}th of the diffraction data accessible with Cu radiation need be used. Applications involving a 240 atom mineral and an 812 atom protein are mentioned.
    Type of Medium: Electronic Resource
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  • 8
    ISSN: 1089-7623
    Source: AIP Digital Archive
    Topics: Physics , Electrical Engineering, Measurement and Control Technology
    Notes: Thin film coatings are susceptible to high intensity x-ray damage. The PHAROS III laser was utilized to generate a point source of x-ray emission used to determine the damage threshold of AR-coated space optics. Thin filters coupled with magnets were used to shield the specimens from thermal radiation and plasma debris. Grids supporting the thin filters could be patterned into the coatings. The surface morphology of damaged specimens has been examined with SEM and AFM microscopes to determine the nature of the damage in multilayer AR coatings. Microscopic techniques were used to measure the depths of coating damage and edge sharpness in the patterned region. © 1995 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 9
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Journal of Applied Physics 81 (1997), S. 1184-1191 
    ISSN: 1089-7550
    Source: AIP Digital Archive
    Topics: Physics
    Notes: Thin film optical coatings are susceptible to damage by high intensity x rays. Time-resolved measurements of this damage are required to better understand the mechanism, so that more rugged coatings can be developed. In the present experiment, dark-field shadowgraphy was used to temporally map the x-ray damage across the surface of certain anti-reflecting (AR) coatings. Two beams from the NRL PHAROS III high power Nd:glass laser system were utilized to generate a point source of plasma x rays, which in turn was used to irradiate and damage the optical coatings. Thin, opaque filters, coupled with permanent magnets and pinholes, were used to shield the optical samples from ultraviolet and charged-particle damage, respectively. The absolute, time-integrated x-ray fluence was measured with a crystal spectrograph, and also was temporally resolved with an x-ray diode. The surface morphology of the damaged optical samples was examined after each shot visually, and later with a profilometer as well as with both scanning electron- and atomic-force microscopes. A measured threshold fluence for damage of 0.049±30% cal/cm2 agrees very well with a radiation-damage code prediction of 0.046 cal/cm2. © 1997 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 10
    Electronic Resource
    Electronic Resource
    Amsterdam : Elsevier
    Ultramicroscopy 38 (1991), S. 169-179 
    ISSN: 0304-3991
    Source: Elsevier Journal Backfiles on ScienceDirect 1907 - 2002
    Topics: Electrical Engineering, Measurement and Control Technology , Natural Sciences in General , Physics
    Type of Medium: Electronic Resource
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