17 research outputs found
Dynamics of polymer chain collapse into compact states
- Author
- Publication venue
- 'American Physical Society (APS)'
- Publication date
- 14/07/2003
- Field of study
Molecular dynamics simulation methods are used to study the folding of
polymer chains into packed cubic states. The polymer model, based on a chain of
linked sites moving in the continuum, includes both excluded volume and
torsional interactions. Different native-state packing arrangements and chain
lengths are explored; the organization of the native state is found to affect
both the ability of the chain to fold successfully and the nature of the
folding pathway as the system is gradually cooled. An order parameter based on
contact counts is used to provide information about the folding process, with
contacts additionally classified according to criteria such as core and surface
sites or local and distant site pairs. Fully detailed contact maps and their
evolution are also examined.Comment: 11 pages, 11 figures (some low resolution
Viral Capsid Proteins Are Segregated in Structural Fold Space
- Author
- Publication venue
- 'Public Library of Science (PLoS)'
- Publication date
- 01/01/2012
- Field of study
10.1371/journal.pcbi.1002905PLoS Computational Biology92e100290
NAMD: a Parallel, Object-Oriented Molecular Dynamics Program
- Author
- Publication venue
- 'SAGE Publications'
- Publication date
- Field of study
Optimization of CHARMM force field parameters for the chalcone fragment
- Author
- A.D. MacKerell Jr
- A.D. MacKerell Jr
- A.D. MacKerell Jr
- A.D. MacKerell Jr
- A.D. MacKerell Jr
- A.P. Scott
- B.R. Brooks
- B.R. Brooks
- B.R. Brooks
- C.L. Brooks III
- D.A. Pearlman
- F.A. Momany
- G. Nemethy
- Hui Zhang
- J. Sarzyńska
- J.A. McCammon
- J.N.C. Lopes
- K. Vanommeslaeghe
- M. Head-Gordon
- M. Levitt
- M. Levitt
- M.J. Frisch
- M.J. Frisch
- M.P. Allen
- N. Foloppe
- P.K. Weiner
- S. Han
- W.F. Gunsteren van
- W.F. Gunsteren van
- W.L. Jorgensen
- W.L. Jorgensen
- W.T. Duncan
- XiaoLi Qi
- Yuan Yao
- ZeSheng Li
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
Comparative docking studies on ligand binding to the multispecific antibodies IgE-La2 and IgE-Lb4
- Author
- A.B. Edmundson
- A.R. Friedman
- A.T. Brünger
- B.L. Stoddard
- C. Branden
- C. Chothia
- C.A. Sotriffer
- C.L. Brooks III
- D.M. Segal
- D.S. Goodsell
- D.S. Goodsell
- E.A. Kabat
- E.C. Meng
- F.F. Richards
- I. Roitt
- I.S. Mian
- J.H. Arevalo
- J.K. Inman
- J.M. Rini
- J.M. Varga
- J.M. Varga
- L. Stryer
- L.M. Amzel
- L.W. Guddat
- N. Metropolis
- P.D. Jeffrey
- P.R. Droupadi
- R. Rosenfeld
- R.A. Mariuzza
- R.D. Davies
- R.L. Stanfield
- S. Sheriff
- S.J. Weiner
- S.J. Weiner
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
Molecular dynamics simulations of peptides from BPTI: A closer look at amide—aromatic interactions
- Author
- A. Bundi
- A. Elofsson
- A. Wlodawer
- A.C. Dios de
- A.E. Mark
- A.R. Buuren Van
- Aldert R. van Buuren
- C.L. Brooks III
- C.P.M. Mierlo Van
- D. Peter Tieleman
- D.A. Case
- David van der Spoel
- E. Tüchsen
- G. Merutka
- G.A. Worth
- H. Bekker
- H.J.C. Berendsen
- H.J.C. Berendsen
- H.J.C. Berendsen
- H.J.C. Berendsen
- H.L. Gordon
- Herman J. C. Berendsen
- J. Caldwell
- J. Cheney
- J. Hernández-Cobos
- J. Kemmink
- J. Kemmink
- J. Kemmink
- J. Mavri
- J.B.O. Mitchell
- J.G. Pearson
- J.M. Thornton
- J.P. Ryckaert
- K. Ösapay
- K. Ösapay
- L.A. Báez
- M.P. Williamson
- MSI
- P. Ahlström
- P. Cieplak
- P.C. Jordan
- P.H. Axelsen
- P.J. Kraulis
- P.O. Åstrand
- P.O. Åstrand
- S. Spera
- S.-B. Zhu
- S.J. Weiner
- S.K. Burley
- S.K. Burley
- W. Kabsch
- W.L. Jorgensen
- W.L. Jorgensen
- W.L. Jorgensen
- X. Daura
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
Fractal analysis of plant spatial patterns: a monitoring tool for vegetation transition shifts
- Author
- A. Bunde
- A. Gonzalez
- A.S. Watt
- B. Cabezudo
- B. Smith
- B. Walker
- B.B. Mandelbrot
- B.B. Mandelbrot
- B.L. Li
- C. L. Alados
- C. Loehle
- C. Loehle
- C. Loehle
- C. Mazancourt
- C. Oyonarte
- C.E. Shannon
- C.E. Shannon
- C.J. Burrows
- C.L. Alados
- C.L. Alados
- C.L. Leheman
- C.R. Johnson
- C.S. Elton
- C.V. Hawkes
- D. C. Freeman
- D. Farmer
- D. Griffiths
- D. Navas
- D. Tilman
- D. Tilman
- D. Tilman
- D. Tilman
- D.A. Frank
- D.A. Frank
- D.A. Rand
- D.G. Milchunas
- D.G. Milchunas
- D.R. Brooks
- D.S. Schimel
- E.C. Pielou
- F. Müller
- F.S. Chapin III
- G. DiCastri
- G.M. Berntson
- H. Olff
- H.N. Le Houérou
- H.V. Cornell
- Hausdorff
- J. Braun-Blanquet
- J. Herrero
- J. Luo
- J. Monserrat Martí
- J.C. Guerrero
- J.C. Guerrero
- J.C. Guerrero
- J.H. Brown
- J.H. Connell
- J.H. Connell
- J.M. Emlen
- J.M. Levine
- J.N. Thompson
- J.P. Grime
- J.P. Grime
- J.R. Krummel
- L. Borda-de-Agua
- L. Gunderson
- L. Stone
- M. Gutiérrez Elorza
- M. Holmgren
- M. Loreou
- M. Peinado
- M. Proulux
- M. Rietkerk
- M. Rietkerk
- M. Scheffer
- M.A. Huston
- M.A. Huston
- M.D. Jennings
- M.J. Crawley
- M.M. Musa
- M.S.J. Floate
- M.W. Palmer
- M.W. Palmer
- M.W. Palmer
- P.M. Vitousek
- Quirantes
- R. Margalef
- R.E. Plotnick
- R.E. Ricklefs
- R.H. Mac Arthur
- R.H. Whittaker
- R.J. Hobbs
- R.W. Chapman
- R.W. Ruess
- S. Frontier
- S. Naeem
- S. Rivas-Martínez
- S.D. Fuhlendorf
- S.D. Wilson
- S.E. Jørgensen
- S.E. Meyer
- S.J. McNaughton
- S.L. Collins
- S.L. Pimm
- S.T.A. Pickett
- T. Wellnitz
- T.B. Milne
- T.W. Therriault
- W.B. Cohen
- Y. Pueyo
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
Seizure-Induced Neuronal Plasticity and Metabolic Effects
- Author
- A. Bordey
- A. Handforth
- A. Hansen
- A. Volterra
- A.H. Ratzliff
- A.J. Lombardo
- A.P. Kudin
- A.R. Brooks-Kayal
- A.W. Yung
- B. Adams
- B. Diehl
- B. Mellstrom
- B.B. Stanfield
- B.K. McCabe
- B.S. Meldrum
- B.S. Meldrum
- B.S. Meldrum
- C. Samuelsson
- C. Steinhauser
- C.D. Binnie
- C.G. Benar
- C.L. Wilson
- C.M. DeGiorgio
- D. Fojtikova
- D.A. Coulter
- D.A. Shewmon
- D.C. McIntyre
- D.F. Emerich
- D.K. Binder
- E. Nakagawa
- E.A. Dennis
- E.A. Nagelhus
- E.D. Hall
- E.R. Perez
- E.R. Taylor
- E.R. Torre
- F. Cendes
- F. Loup
- F.H. Lopes da Silva
- F.J. Rugg-Gunn
- G. Kohr
- G. Zhang
- G.F. Tian
- G.J. Zipfel
- G.L. Holmes
- G.W. Mathern
- H. Beck
- H. Bjornaes
- H. Meierkord
- H. Monyer
- H. Straub
- H.R. Cock
- I. Khalilov
- I. Khalilov
- I. Mody
- J. Engel Jr
- J. Natsume
- J. Nissinen
- J.A. Gorter
- J.A. Gorter
- J.A. Stanley
- J.E. Cavazos
- J.E. Cavazos
- J.E. Cavazos
- J.E. Kraus
- J.M. Parent
- J.W. Gibbs III
- J.W. Olney
- J.W. Olney
- J.W. Swann
- K. Benedek
- K. Lukasiuk
- K. Morimoto
- L. Bianchi
- L. Huang
- L. Lemieux
- L. Mackenzie
- L. Pickard
- L.L. Bailet
- M. Barbarosie
- M. Castillo
- M. Esclapez
- M. Glass
- M. Isokawa
- M. Jiang
- M. Lynch
- M. Raza
- M. Suh
- M. Suh
- M. Suh
- M. Vreugdenhil
- M. Wong
- M.A. Cortez
- M.B. Moser
- M.J. During
- M.J. During
- M.L. Olsen
- M.R. Sarkisian
- M.V. Frantseva
- M.V. Frantseva
- M.V. Frantseva
- O.A. Petroff
- P. Bernardi
- P. Kwan
- P.A. Schwartzkroin
- P.E. Hughes
- P.E. Schauwecker
- P.M. Matthews
- R. Cossart
- R. D’Ambrosio
- R. Kotloski
- R. Sanchez-Carpintero
- R. Sankar
- R. Sankar
- R.D. Andrew
- R.D. Tien
- R.M. Kluck
- R.S. Briellmann
- R.S. Liu
- R.S. Sloviter
- R.S. Sloviter
- S. Bahar
- S. Dreifuss
- S. Gabriel
- S. Hinterkeuser
- S. Pal
- S. Pal
- S.A. Lipton
- S.G. Mueller
- S.Y. Yoo
- T. Eid
- T. Eid
- T. Kimiwada
- T. Salmenpera
- T. Sutula
- T.L. Babb
- T.M. Grisar
- T.M. Madsen
- T.S. Lee
- U. Ebert
- W. Jiang
- W.D. Gaillard
- W.S. Kunz
- X. Qiao
- Y. Ben-Ari
- Y. Ueda
- Y. Wang
- Y.C. Chuang
- Z. Feng
- Z. Nusser
- Z.C. Ye
- Publication venue
- 'Springer Science and Business Media LLC'
- Publication date
- Field of study
Full Issue in PDF / Numéro complet enform PDF
- Author
- Abel P.
- Abel P.
- Acharya Y.B.
- Ahokas E.
- amur M.Z.
- Anderson K.
- Angal A.
- Antoine D.
- Antoine D.
- Arvesen J.C.
- Ashburn E.V.
- Asrar G.
- Baldocchi D.
- Bannari A.
- Bannari A.
- Barbosa P.M.
- Barnes R.A.
- Barnes R.A.
- Barnes W.L.
- Barsi J.
- Barsi J.A.
- Biggar S.F.
- Biggar S.F.
- Biggar S.F.
- Biggar S.F.
- Biggar S.F.
- Black S.E.
- Blonski S.
- Blumberg D.G.
- Bolton D.
- Bowker D.E.
- Boyd P.W.
- Brando V.E.
- Brasseur G.
- Brest C.L.
- Brest C.L.
- Brest C.L.
- Brooks D.R.
- Brown S.W.
- Bruegge C.
- Cabot F.
- Cabot F.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Cao C.
- Castle K.R.
- Chander G.
- Chander G.
- Chander G.
- Chander G.
- Che H.
- Che N.
- Chesters D.
- Choudhury B.J.
- Cihlar J.
- Clark D.
- Clark D.K.
- Coltman J.W.
- Cosnefroy H.
- Cosnefroy H.
- Cosnefroy H.
- Cosnefroy H.
- Coulson K.L.
- Czapla-Myers J.S.
- D'Alimonte D.
- D'Alimonte D.
- Davis G.
- Davis J.M.
- de Vries C.
- Delvit J.
- Delwart S.
- Deschamps P.-Y.
- Desormeaux Y.
- Dinguirard M.
- Doherty S.J.
- Dong C.
- Donlon C.J.
- Drinkwater M.R.
- Dubovik O.
- Dubovik O.
- Duggin M.J.
- Eck T.F.
- Ehsani A.R.
- Elliott W.P.
- Esaias W.
- Faiman D.
- Fairall C.W.
- Feng H.
- Field C.B.
- Fougnie B.
- Fox N.P.
- Fox N.P.
- Fraser R.S.
- Fraser R.S.
- Frouin R.
- Gao B.-C.
- Getis A.
- Godden G.D.
- Gordon H.R.
- Gordon H.R.
- Goward S.
- Gregg W.
- Grey W.
- Gu S.
- Gu X.F.
- Gu X.F.
- Guenther B.
- Halthore R.N.
- Harris A.R.
- Heidinger A.K.
- Heidinger A.K.
- Heidinger A.K.
- Heidinger A.K.
- Helder D.L.
- Holben B.N.
- Holben B.N.
- Holben B.N.
- Holben B.N.
- Holben B.N.
- Holben B.N.
- Holben B.N.
- Holben B.N.
- Honkavaara E.
- Hook S.
- Hook S.J.
- Hook S.J.
- Hook S.J.
- Hooker S.B.
- Hooker S.B.
- Hooker S.B.
- Horrocks L.A.
- Hu C.
- Hu X.
- Hu X.Q.
- Hu X.Q.
- Hudson S.
- Hudson S.R.
- Hyland R.W.
- Ignatov A.
- Isaacman A.
- Iwabuchi H.
- Jackson R.D.
- Jackson R.D.
- Jaross G.
- Justice C.
- Justice C.O.
- Kamstrup N.
- Kaufman Y.J.
- Kaufman Y.J.
- Kaufman Y.J.
- Kerola D.X.
- Kieffer H.H.
- King M.
- King M.D.
- Kishino M.
- Koepke P.
- Konda M.
- Kuwahara V.S.
- Lawrence J.S.
- Lawrence J.S.
- Le Marshall J.F.
- Li X.
- Li X.
- Li Y.
- Li Y.
- Li Y.
- Lindberg J.D.
- Liu C.C.
- Liu J.-J.
- Liu J.J.
- Loeb N.G.
- Loeb N.G.
- Loeb N.G.
- Loeb N.G.
- Loeb N.G.
- Loveland T.R.
- Lucht W.
- Markham B.L.
- Markham B.L.
- Martiny N.
- Masonis S.J.
- Mayer B.
- McClain C.R.
- McManus J.F.
- Miesch C.
- Mims F.M. III.
- Mims F.M. III.
- Min X.
- Minnett P.
- Minnis P.
- Mitchell R.M.
- Mitchell R.M.
- Mitchell R.M.
- Mobley C.
- Moran M.S.
- Morstad D.L.
- Mueller J.L.
- Myneni R.B.
- Myneni R.B.
- Mélin F.
- Mélin F.
- Neckel H.
- Nieke J.
- Nithianandam J.
- O'Brien D.M.
- Ohring G.
- Otterman J.
- Ottle C.
- Parkinson C.L.
- Pinkerton M.H.
- Prabhakara C.
- Price J.C.
- Price J.C.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao C.R.N.
- Rao N.
- Richter R.
- Rodger A.P.
- Rondeaux G.
- Rondeaux G.
- Salomonson V.V.
- Sandholt I.
- Santer R.
- Santer R.
- Sarmiento J.L.
- Schaaf C.B.
- Schluessel P.
- Schott J.
- Schott J.R.
- Schott J.R.
- Schott J.R.
- Schroeder M.
- Scott K.P.
- Secker J.
- Six D.
- Six D.
- Six D.
- Six D.
- Six D.
- Six D.
- Slater P.N.
- Slater P.N.
- Slater P.N.
- Slater P.N.
- Slater P.N.
- Slater P.N.
- Slater P.N.
- Slater P.N.
- Smith D.
- Smith D.L.
- Smith D.L.
- Smith D.L.
- Smith G.R.
- Smith G.R.
- Smith G.R.
- Snyder W.C.
- Staylor W.F.
- Staylor W.F.
- Stokes G.M.
- Storey J.C.
- Sun J.
- Tahnk W.R.
- Tahnk W.R.
- Tahnk W.R.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Teillet P.M.
- Thomas J.R.
- Thome K.
- Thome K.
- Thome K.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thome K.J.
- Thuiller G.
- Thuillier G.
- Thuillier G.
- Tian B.
- Tomasi C.
- Tomasi C.
- Tonooka H.
- Toole D.A.
- Tucker C.J.
- Valorge C.
- Vermote E.
- Vermote E.
- Vermote E.
- Vermote E.
- Vermote E.
- Vermote E.
- Vermote E.F.
- Vermote E.F.
- Vermote E.F.
- Vermote E.F.
- Vermote E.F.
- Vermote E.F.
- Vizy E.K.
- Wan Z.
- Wang M.
- Wanner W.
- Warren S.G.
- Warren S.G.
- Warren S.G.
- Warren S.G.
- Wenny B.
- Wenny B.N.
- Wenny B.N.
- Werdell J.P.
- Wheeler R.J.
- Wu A.
- Wu A.
- Wu D.
- Wu X.
- Xia X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.
- Xiong X.X.
- Xiong X.X.
- Yu F.
- Yu F.
- Yu F.
- Yu F.
- Zeng X.
- Zhang Y.
- Zhang Y.
- Zhang Y.
- Zhang Y.
- Zhang Y.
- Zhang Y.
- Zheng Y.
- Zibordi G.
- Zibordi G.
- Zibordi G.
- Zibordi G.
- Zibordi G.
- Zibordi G.
- Zibordi G.
- Publication venue
- 'Canadian Aeronautics and Space Institute'
- Publication date
- Field of study
Recommended from our members
The James Webb Space Telescope Mission
- Author
- Abbott R.
- Abell J.S.
- Abernathy M.
- Abney F.E.
- Abraham J.G.
- Abraham R.
- Abul-Huda Y.M.
- Acton S.
- Adams C.K.
- Adams E.
- Adler D.S.
- Adriaensen M.
- Aguilar J.A.
- Ahmed M.
- Ahmed N.S.
- Ahmed T.
- Alarcon R.R.
- Albat R.
- Albert L.
- Alberts S.
- Aldridge D.
- Allen M.M.
- Allen S.S.
- Altenburg M.
- Altunc S.
- Alvarez J.L.
- Ambrose L.L.
- Anandakrishnan S.M.
- Andersen G.C.
- Anderson H.J.
- Anderson J.
- Anderson K.
- Anderson S.M.
- Aprea J.
- Archer B.J.
- Arenberg J.W.
- Argyriou I.
- Arribas S.
- Artigau I.
- Arvai A.R.
- Atcheson P.
- Atkinson C.B.
- Averbukh J.
- Aymergen C.
- Bacinski J.J.
- Baggett W.E.
- Bagnasco G.
- Baker L.L.
- Balzano V.A.
- Banks K.A.
- Baran D.A.
- Barker E.A.
- Barrett L.K.
- Barringer B.O.
- Barto A.
- Bast W.
- Baudoz P.
- Baum S.
- Beatty T.G.
- Beaulieu M.
- Bechtold K.
- Beck T.
- Beddard M.M.
- Beichman C.
- Bellagama L.
- Bely P.
- Berger T.W.
- Bergeron L.E.
- Bernier A.-D.
- Bertch M.D.
- Beskow C.
- Betz L.E.
- Biagetti C.P.
- Birkmann S.
- Bjorklund K.F.
- Blackwood J.D.
- Blazek R.P.
- Blossfeld S.
- Bluth M.
- Boccaletti A.
- Boegner Jr, M.E.
- Bohlin R.C.
- Boia J.J.
- Bonaventura N.
- Bond N.A.
- Bosley K.A.
- Boucarut R.A.
- Bouchet P.
- Bouwman J.
- Bower G.
- Bowers A.S.
- Bowers C.W.
- Boyce L.A.
- Boyer C.T.
- Boyer M.
- Boyer M.L.
- Boyer R.
- Bradley L.D.
- Brady G.R.
- Brandl B.R.
- Brannen J.L.
- Breda D.
- Bremmer H.G.
- Brennan D.
- Bresnahan P.A.
- Bright S.N.
- Broiles B.J.
- Bromenschenkel A.
- Brooks B.H.
- Brooks K.J.
- Brown B.
- Brown B.
- Brown T.M.
- Bruce B.W.
- Bryson J.G.
- Bujanda E.D.
- Bullock B.M.
- Bunker A.J.
- Bureo R.
- Burt I.J.
- Bush J.A.
- Bushouse H.A.
- Bussman M.C.
- Böker T.
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- Östlin G.
- Publication venue
- Institute of Physics
- Publication date
- 26/06/2023
- Field of study
Twenty-six years ago a small committee report, building on earlier studies, expounded a compelling and poetic vision for the future of astronomy, calling for an infrared-optimized space telescope with an aperture of at least 4 m. With the support of their governments in the US, Europe, and Canada, 20,000 people realized that vision as the 6.5 m James Webb Space Telescope. A generation of astronomers will celebrate their accomplishments for the life of the mission, potentially as long as 20 yr, and beyond. This report and the scientific discoveries that follow are extended thank-you notes to the 20,000 team members. The telescope is working perfectly, with much better image quality than expected. In this and accompanying papers, we give a brief history, describe the observatory, outline its objectives and current observing program, and discuss the inventions and people who made it possible. We cite detailed reports on the design and the measured performance on orbit. © 2023. The Author(s). Published by IOP Publishing Ltd on behalf of the Astronomical Society of the Pacific (ASP). All rights reserved.Open access articleThis item from the UA Faculty Publications collection is made available by the University of Arizona with support from the University of Arizona Libraries. If you have questions, please contact us at [email protected]