Search results for "crystallography"

Hits ?▲	Authors	Title	Venue	Year	Link	Author keywords
81	Tod D. Romo, Kreshna Gopal, Erik McKee, Lalji Kanbi, Reetal Pai, Jacob N. Smith, James C. Sacchettini, Thomas R. Ioerger	TEXTAL: AI-Based Structural Determination for X-ray Protein Crystallography.	IEEE Intell. Syst.	2005	DBLP DOI BibTeX RDF	X-ray crystallography, pattern recognition, artificial intelligence, structural biology
65	Monica Duke, Michael Day 0001, Rachel Heery, Les Carr, Simon J. Coles	Enhancing access to research data: the challenge of crystallography.	JCDL	2005	DBLP DOI BibTeX RDF	Eprints.org, metadata, OAI-PMH, dublin core, institutional repositories, scholarly communication, crystallography
56	Diane C. Jamrog, George N. Phillips Jr., Richard A. Tapia, Yin Zhang 0010	A global optimization method for the molecular replacement problem in X-ray crystallography.	Math. Program.	2005	DBLP DOI BibTeX RDF	Mathematics Subject Classification (2000) 20E28, 20G40, 20C20
48	Charles Brooking, Stephen R. Shouldice, Gautier Robin, Bostjan Kobe, Jennifer L. Martin, Jane Hunter 0001	Comparing METS and OAI-ORE for Encapsulating Scientific Data Products: A Protein Crystallography Case Study.	eScience	2009	DBLP DOI BibTeX RDF	oai-ore mets crystallography lims repositories
48	Manjula Patel, Simon J. Coles, David Giaretta, Stephen Rankin, Brian McIlwrath	The Role of OAIS Representation Information in the Digital Curation of Crystallography Data.	eScience	2009	DBLP DOI BibTeX RDF	Crystallography data, Representation Information, OAIS Reference Model, Preservation, Digital curation
46	Chérif F. Matta	Quantum crystallography: From the intersection to the union of crystallography and quantum mechanics.	J. Comput. Chem.	2018	DBLP DOI BibTeX RDF
41	Jim Morey, Kamran Sedig, Robert E. Mercer, M. Wayne Wilson	Crystal Lattice Automata.	CIAA	2001	DBLP DOI BibTeX RDF	lattice, automata, tiling, microworlds, crystallography
41	Ilya N. Shindyalov, Weider Chang, J. A. Cooper, Philip E. Bourne	Design and use of a software framework to obtain information derived from macromolecular structure data.	HICSS (5)	1995	DBLP DOI BibTeX RDF	macromolecules, macromolecular structure data, extensible object oriented framework, biological macromolecules, biological significance, simple verification, single 3D coordinate set, X-ray crystallography, NMR studies, disparate experimental data sets, information retrieval, object-oriented programming, object-oriented databases, biology computing, software framework, molecular configurations
39	Alexandre Urzhumtsev, Natalia Lunina, Pavel V. Afonine, Vladimir Y. Lunin	Some Applications of Dummy Point Scatterers for Phasing in Macromolecular X-Ray Crystallography.	CompLife	2005	DBLP DOI BibTeX RDF
39	Leah Sandvoss, Dennis P. Groth	Development of an Informatics Tool for Crystallography Laboratory Administrators.	SSDBM	2003	DBLP DOI BibTeX RDF
33	A. B. M. Russel, Asad I. Khan	Towards dynamic data grid framework for eResearch.	ACSW	2006	DBLP BibTeX RDF	CIMA, SRB, eResearch, data grid, gridFTP
33	Hao Yin, Donald F. McMullen, Mehmet A. Nacar, Marlon E. Pierce, Kianosh Huffman, Geoffrey C. Fox, Yu Ma	Providing Portlet-Based Client Access to CIMA-Enabled Crystallographic Instruments, Sensors, and Data.	GRID	2006	DBLP DOI BibTeX RDF
33	Jeremy G. Frey, Sam Peppe, Mike Surridge, Ken Meacham, Simon J. Coles, Michael B. Hursthouse, Mark E. Light, Hugo R. Mills, David De Roure, Graham Smith, Ed Zaluska	Grid-Enabling an Existing Instrument-Based National Service.	e-Science	2005	DBLP DOI BibTeX RDF
33	Jaime Seguel, Daniel Burbano	A Scalable Crystallographic FFT.	PVM/MPI	2003	DBLP DOI BibTeX RDF
33	Peter C. Doerschuk	Bayesian reconstruction of signals invariant under a space-group symmetry from Fourier transform magnitudes.	IEEE Trans. Image Process.	1994	DBLP DOI BibTeX RDF
25	Prasad Gunasekaran, Scott Grandison, Kevin Cowtan, Lora Mak, David M. Lawson, Richard J. Morris	Ligand Electron Density Shape Recognition Using 3D Zernike Descriptors.	PRIB	2009	DBLP DOI BibTeX RDF	electron density, protein crystallography, 3D Zernike moments, pattern recognition, structural bioinformatics
25	Elizabeth R. Chen	A Dense Packing of Regular Tetrahedra.	Discret. Comput. Geom.	2008	DBLP DOI BibTeX RDF	Regular solid, Hilbert problem, Packing, Crystallography
25	Joshua L. Payne, Margaret J. Eppstein	A hybrid genetic algorithm with pattern search for finding heavy atoms in protein crystals.	GECCO	2005	DBLP DOI BibTeX RDF	crystallographic phasing, heavy atom method, isomorphous replacement, phase problem, genetic algorithms, pattern search, hybrid evolutionary algorithms, crystallography
25	John J. Cannon	Computers in group theory: a survey.	Commun. ACM	1969	DBLP DOI BibTeX RDF	character tables, commutator calculus, coset enumeration, nonnumerical programming, subgroup lattices, topology, survey, symbol manipulation, group theory, discrete mathematics, permutation groups, Abelian groups, automorphism groups, crystallography
23	Kaylen R. Meeks, Juan Ji, Mykola V. Protopopov, Olga O. Tarkhanova, Yurii S. Moroz, John J. Tanner	Novel Fragment Inhibitors of PYCR1 from Docking-Guided X-ray Crystallography.	J. Chem. Inf. Model.	2024	DBLP DOI BibTeX RDF
23	Oleg Mikhailovskii, Sergei A. Izmailov, Yi Xue, David A. Case, Nikolai R. Skrynnikov	X-ray Crystallography Module in MD Simulation Program Amber 2023. Refining the Models of Protein Crystals.	J. Chem. Inf. Model.	2024	DBLP DOI BibTeX RDF
23	Te Liu, Sichao Huang, Qian Zhang, Yu Xia, Manjie Zhang, Bin Sun 0005	Reconciling ASPP-p53 binding mode discrepancies through an ensemble binding framework that bridges crystallography and NMR data.	PLoS Comput. Biol.	2024	DBLP DOI BibTeX RDF
23	Jack B. Greisman, Lindsay Willmore, Christine Y. Yeh, Fabrizio Giordanetto, Sahar Shahamadtar, Hunter M. Nisonoff, Paul Maragakis, David E. Shaw	Discovery and Validation of the Binding Poses of Allosteric Fragment Hits to Protein Tyrosine Phosphatase 1b: From Molecular Dynamics Simulations to X-ray Crystallography.	J. Chem. Inf. Model.	2023	DBLP DOI BibTeX RDF
23	Cong Wang, Po-Nan Li, Jana Thayer, Chun Hong Yoon	PeakNet: Bragg peak finding in X-ray crystallography experiments with U-Net.	CoRR	2023	DBLP DOI BibTeX RDF
23	Jianan Xie, Ji Liu 0008, Chi Zhang, Xihui Chen, Ping Huai, Jie Zheng, Xiaofeng Zhang	Weakly supervised learning for pattern classification in serial femtosecond crystallography.	CoRR	2023	DBLP DOI BibTeX RDF
23	Antanas Vaitkus, Andrius Merkys, Thomas Sander, Miguel Quirós, Paul A. Thiessen, Evan E. Bolton, Saulius Grazulis	A workflow for deriving chemical entities from crystallographic data and its application to the Crystallography Open Database.	J. Cheminformatics	2023	DBLP DOI BibTeX RDF
23	Holger Klein, Stéphanie Kodjikian, Emre Yörük, Pierre Bordet	Low-Dose Electron Crystallography: Structure Solution and Refinement.	Symmetry	2022	DBLP DOI BibTeX RDF
23	Robert Underwood, Chun Hong Yoon, Ali Murat Gok, Sheng Di, Franck Cappello	ROIBIN-SZ: Fast and Science-Preserving Compression for Serial Crystallography.	CoRR	2022	DBLP DOI BibTeX RDF
23	Jeffrey L. Mendenhall, Benjamin P. Brown, Sandeepkumar Kothiwale, Jens Meiler	BCL: : Conf: Improved Open-Source Knowledge-Based Conformation Sampling Using the Crystallography Open Database.	J. Chem. Inf. Model.	2021	DBLP DOI BibTeX RDF
23	Rebecca M. Twidale, Philip Hinchliffe, James Spencer, Adrian J. Mulholland	Crystallography and QM/MM Simulations Identify Preferential Binding of Hydrolyzed Carbapenem and Penem Antibiotics to the L1 Metallo-β-Lactamase in the Imine Form.	J. Chem. Inf. Model.	2021	DBLP DOI BibTeX RDF
23	Phillip M. Maffettone, Lars Banko, Peng Cui, Yury Lysogorskiy, Marc A. Little, Daniel Olds, Alfred Ludwig, Andrew I. Cooper	Crystallography companion agent for high-throughput materials discovery.	Nat. Comput. Sci.	2021	DBLP DOI BibTeX RDF
23	Gerard Deepak, Zameer Gulzar, A. Anny Leema	An intelligent system for modeling and evaluation of domain ontologies for Crystallography as a prospective domain with a focus on their retrieval.	Comput. Electr. Eng.	2021	DBLP DOI BibTeX RDF
23	Lingyao Chen, Kang Xu, Xiaoying Zheng, Yongxin Zhu 0001, Yi Jing	Image Distillation Based Screening for X-ray Crystallography Diffraction Images.	ISPA/BDCloud/SocialCom/SustainCom	2021	DBLP DOI BibTeX RDF
23	Pharit Kamsri, Chayanin Hanwarinroj, Naruedon Phusi, Thimpika Pornprom, Kampanart Chayajarus, Auradee Punkvang, Nitima Suttipanta, Potjanee Srimanote, Khomson Suttisintong, Chomphunuch Songsiriritthigul, Patchreenart Saparpakorn, Supa Hannongbua, Siriluk Rattanabunyong, Supaporn Seetaha, Kiattawee Choowongkomon, Sanya Sureram, Prasat Kittakoop, Poonpilas Hongmanee, Pitak Santanirand, Zhaoqiang Chen, Weiliang Zhu, Rosemary A. Blood, Yuiko Takebayashi, Philip Hinchliffe, Adrian J. Mulholland, James Spencer, Pornpan Pungpo	Discovery of New and Potent InhA Inhibitors as Antituberculosis Agents: Structure-Based Virtual Screening Validated by Biological Assays and X-ray Crystallography.	J. Chem. Inf. Model.	2020	DBLP DOI BibTeX RDF
23	Markus Kühbach, Matthew Kasemer, Baptiste Gault, Andrew Breen	On Open and Strong-Scaling Tools for Atom Probe Crystallography: High-Throughput Methods for Indexing Crystal Structure and Orientation.	CoRR	2020	DBLP BibTeX RDF
23	Malik Zawwar Hussain, Shama Yousaf, Tayba Arooj	Simulation and modeling of diffraction pattern of crystallography: a fractal approach.	Comput. Appl. Math.	2020	DBLP DOI BibTeX RDF
23	Kamal Al Nasr, Qasem Abu Al-Haija	Forecasting the Growth of Structures from NMR and X-Ray Crystallography Experiments Released Per Year.	J. Inf. Knowl. Manag.	2020	DBLP DOI BibTeX RDF
23	Amir Tosson, Mohammad Shokr, Ullrich Pietsch	Application of Cloud Computing for Big Data in the X-Ray Crystallography Community.	ICSIM	2020	DBLP DOI BibTeX RDF
23	Amir Tosson	The way to a smarter community: exploring and exploiting data modeling, big data analytics, high-performance computing and artificial intelligence techniques for applications of 2D energy-dispersive detectors in the crystallography community.		2020	RDF
23	Artur L. F. Souza, Leonardo B. Oliveira, Sabine Hollatz, Matthew Feldman, Kunle Olukotun, James M. Holton, Aina E. Cohen, Luigi Nardi	DeepFreak: Learning Crystallography Diffraction Patterns with Automated Machine Learning.	CoRR	2019	DBLP BibTeX RDF
23	Kevin Kaufmann, Chaoyi Zhu, Alexander S. Rosengarten, Daniel Maryanovsky, Tyler J. Harrington, Eduardo Marin, Kenneth S. Vecchio	Paradigm shift in electron-based crystallography via machine learning.	CoRR	2019	DBLP BibTeX RDF
23	Jonathan Schurmann, Isaak Lindhè, Jörn W. Janneck, Gustavo M. A. Lima, Zdenek Matej	Crystal centering using deep learning in X-ray crystallography.	ACSSC	2019	DBLP DOI BibTeX RDF
23	Brendan Sullivan, Rick Archibald, Venu Vandavasi, Patricia Langan, Leighton Coates, Vickie Lynch	Volumetric Segmentation via Neural Networks Improves Neutron Crystallography Data Analysis.	CCGRID	2019	DBLP DOI BibTeX RDF
23	Jhon Angarita, Samuel Pinilla, Hans Garcia, Henry Arguello	Multi-resolution Reconstruction Algorithm for Phase Retrieval in X-ray Crystallography.	EUSIPCO	2019	DBLP DOI BibTeX RDF
23	Vladimir G. Tsirelson	Early days of quantum crystallography: A personal account.	J. Comput. Chem.	2018	DBLP DOI BibTeX RDF
23	Lou Massa, Chérif F. Matta	Quantum crystallography: A perspective.	J. Comput. Chem.	2018	DBLP DOI BibTeX RDF
23	Miguel Quirós, Saulius Grazulis, Saule Girdzijauskaite, Andrius Merkys, Antanas Vaitkus	Using SMILES strings for the description of chemical connectivity in the Crystallography Open Database.	J. Cheminformatics	2018	DBLP DOI BibTeX RDF
23	Samuel Pinilla, Hans Garcia, Luis Díaz, Juan Poveda, Henry Arguello	Coded aperture design for solving the phase retrieval problem in X-ray crystallography.	J. Comput. Appl. Math.	2018	DBLP DOI BibTeX RDF
23	Phani Ghanakota, Heather A. Carlson	Comparing pharmacophore models derived from crystallography and NMR ensembles.	J. Comput. Aided Mol. Des.	2017	DBLP DOI BibTeX RDF
23	Ian J. Bruno, Saulius Grazulis, John R. Helliwell, Soorya N. Kabekkodu, Brian McMahon, John D. Westbrook	Crystallography and Databases.	Data Sci. J.	2017	DBLP DOI BibTeX RDF
23	Samuel Pinilla, Tatiana Gelvez, Henry Arguello	Boolean approximation of a phase-coded aperture diffraction pattern system for X-ray crystallography.	CAMSAP	2017	DBLP DOI BibTeX RDF
23	B. M. Thamali Lekamge, Arcot Sowmya, Janet Newman	Multi-view Learning for Classification of X-Ray Crystallography Images.	MLDM	2016	DBLP DOI BibTeX RDF
23	Meng Li, Lianqing Liu, Niandong Jiao, Peng Yu, Ning Xi 0001, Yuechao Wang	Probing crystallography-induced anisotropy and periodic property of atomic friction in MoS2 via fast Fourier transform processing.	NEMS	2016	DBLP DOI BibTeX RDF
23	Gregory S. Chirikjian	Kinematics Meets Crystallography: The Concept of a Motion Space1.	J. Comput. Inf. Sci. Eng.	2015	DBLP DOI BibTeX RDF
23	Vojtech Kopský	Crystallography and Magnetic Phenomena.	Symmetry	2015	DBLP DOI BibTeX RDF
23	Daniel A. Keedy, James S. Fraser, Henry van den Bedem	Exposing Hidden Alternative Backbone Conformations in X-ray Crystallography Using qFit.	PLoS Comput. Biol.	2015	DBLP DOI BibTeX RDF
23	Romain D. Arnal, Rick P. Millane	Uniqueness for ab initio phase retrieval in macromolecular X-ray crystallography.	IVCNZ	2015	DBLP DOI BibTeX RDF
23	Dowman P. Varn, James P. Crutchfield	Chaotic Crystallography: How the physics of information reveals structural order in materials.	CoRR	2014	DBLP BibTeX RDF
23	Jack Yang 0001, Mark P. Waller	Revealing noncovalent interactions in quantum crystallography: Taurine revisited.	J. Comput. Chem.	2013	DBLP DOI BibTeX RDF
23	Katrina W. Lexa, Heather A. Carlson	Improving Protocols for Protein Mapping through Proper Comparison to Crystallography Data.	J. Chem. Inf. Model.	2013	DBLP DOI BibTeX RDF
23	Peter J. Sadowski, Pierre Baldi	Small-Molecule 3D Structure Prediction Using Open Crystallography Data.	J. Chem. Inf. Model.	2013	DBLP DOI BibTeX RDF
23	Jiapu Zhang	Simulated annealing: in mathematical global optimization computation, hybrid with local or global search, and practical applications in crystallography and molecular modelling.	CoRR	2013	DBLP BibTeX RDF
23	Yang Lei, Ramgopal R. Mettu	A Confidence Measure for Model Fitting with X-Ray Crystallography Data.	BCB	2013	DBLP DOI BibTeX RDF
23	Saulius Grazulis, Adriana Daskevic, Andrius Merkys, Daniel Chateigner, Luca Lutterotti, Miguel Quirós, Nadezhda R. Serebryanaya, Peter Moeck, Robert T. Downs, Armel Le Bail	Crystallography Open Database (COD): an open-access collection of crystal structures and platform for world-wide collaboration.	Nucleic Acids Res.	2012	DBLP DOI BibTeX RDF
23	Alena Solcova, Michal Krízek	Vladimír Vand (1911-1968): Pioneer of Computational Methods in Crystallography.	IEEE Ann. Hist. Comput.	2011	DBLP DOI BibTeX RDF
23	Tilo Strutz	3D Shape Reconstruction of Loop Objects in X-Ray Protein Crystallography.	IEEE ACM Trans. Comput. Biol. Bioinform.	2011	DBLP DOI BibTeX RDF
23	Solange Delagenière, Patrice Brenchereau, Ludovic Launer, Alun W. Ashton, Ricardo Leal, Stéphanie Veyrier, José Gabadinho, Elspeth J. Gordon, Samuel D. Jones, Karl Erik Levik, Seán M. McSweeney, Stéphanie Monaco, Max Nanao, Darren Spruce, Olof Svensson, Martin A. Walsh, Gordon A. Leonard	ISPyB: an information management system for synchrotron macromolecular crystallography.	Bioinform.	2011	DBLP DOI BibTeX RDF
23	Nabraj Bhattarai, Subarna Khanal, Pushpa Raj Pudasaini, Shanna Pahl, Dulce Romero-Urbina	Citrate Stabilized Silver Nanoparticles: Study of Crystallography and Surface Properties.	Int. J. Nanotechnol. Mol. Comput.	2011	DBLP DOI BibTeX RDF
23	Daniel de Oliveira 0001, Kary A. C. S. Ocaña, Eduardo S. Ogasawara, Jonas Dias, Fernanda Araújo Baião, Marta Mattoso	A Performance Evaluation of X-Ray Crystallography Scientific Workflow Using SciCumulus.	IEEE CLOUD	2011	DBLP DOI BibTeX RDF	Cloud Computing, Scientific Workflows
23	Gunnar F. Schröder, Michael Levitt, Axel T. Brünger	Super-resolution biomolecular crystallography with low-resolution data.	Nat.	2010	DBLP DOI BibTeX RDF
23	Corinna Heldt, Alexander Bockmayr	Geometric Constraints for the Phase Problem in X-Ray Crystallography.	WCB@ICLP	2010	DBLP DOI BibTeX RDF
23	Herbert A. Hauptman	Phase Problem in X-ray Crystallography: Shake and Bake Approach.	Encyclopedia of Optimization	2009	DBLP DOI BibTeX RDF	Phase problem, Normalized structure factors, Structure invariants, Minimal function, Minimal principle, Shake and bake algorithm, Global optimization
23	Maryjane Tremayne, Samantha Y. Chong, Duncan Bell	Optimisation of algorithm control parameters in cultural differential evolution applied to molecular crystallography.	Frontiers Comput. Sci. China	2009	DBLP DOI BibTeX RDF	cultural evolution, powder diffraction, crystal structure solution, global optimisation, evolutionary algorithms, differential evolution
23	Kreshna Gopal	Efficient case-based reasoning through feature weighting, and its application in protein crystallography.		2009	RDF
23	Manjula Patel, Alexander Ball	Challenges and Issues Relating to the Use of Representation Information for the Digital Curation of Crystallography and Engineering Data.	Int. J. Digit. Curation	2008	DBLP DOI BibTeX RDF
23	Peter R. Strickland, Brian McMahon, John R. Helliwell	Integrating research articles and supporting data in crystallography.	Learn. Publ.	2008	DBLP DOI BibTeX RDF
23	Trias Thireou, Vassilis Atlamazoglou, Manolis Levakis, Elias Eliopoulos, Athanassios Hountas, George Tsoucaris, Kostas Bethanis	CrystTwiV: a webserver for automated phase extension and refinement in X-ray crystallography.	Nucleic Acids Res.	2007	DBLP DOI BibTeX RDF
23	Pilar Martínez Ortigosa, Juana López Redondo, Inmaculada García, José-Jesús Fernández	A population global optimization algorithm to solve the image alignment problem in electron crystallography.	J. Glob. Optim.	2007	DBLP DOI BibTeX RDF
23	Eran Eyal, Chakra Chennubhotla 0001, Lee-Wei Yang, Ivet Bahar	Anisotropic fluctuations of amino acids in protein structures: insights from X-ray crystallography and elastic network models.	ISMB/ECCB (Supplement of Bioinformatics)	2007	DBLP DOI BibTeX RDF
23	Ludovic Renault, Hui-Ting Chou, Po-Lin Chiu, Rena M. Hill, Xiangyan Zeng, Bryant Gipson, Zi Yan Zhang, An-Chi Chen, Vinzenz Unger, Henning Stahlberg	Milestones in electron crystallography.	J. Comput. Aided Mol. Des.	2006	DBLP DOI BibTeX RDF
23	Simon J. Coles, Jeremy G. Frey, Michael B. Hursthouse, Mark E. Light, Andrew J. Milsted, Leslie Carr, David De Roure, Christopher Gutteridge, Hugo R. Mills, Ken Meacham, Mike Surridge, Elizabeth Josephine Lyon, Rachel Heery, Monica Duke, Michael Day 0001	An E-Science Environment for Service Crystallography-from Submission to Dissemination.	J. Chem. Inf. Model.	2006	DBLP DOI BibTeX RDF
23	John R. Helliwell, Peter R. Strickland, Brian McMahon	The role of quality in providing seamless access to information and data in e-science; the experience gained in crystallography.	Inf. Serv. Use	2006	DBLP DOI BibTeX RDF
23	Kreshna Gopal, Tod D. Romo, James C. Sacchettini, Thomas R. Ioerger	Determining Relevant Features to Recognize Electron Density Patterns in X-ray Protein Crystallography.	J. Bioinform. Comput. Biol.	2005	DBLP DOI BibTeX RDF
23	Tommaso Toffoli	A pedestrian's introduction to spacetime crystallography.	IBM J. Res. Dev.	2004	DBLP DOI BibTeX RDF
23	Anna C. Tanczos, Rex A. Palmer, Brian S. Potter, José W. Saldanha, Brendan J. Howlin	Antagonist binding in the rat muscarinic receptor: A study by docking and X-ray crystallography.	Comput. Biol. Chem.	2004	DBLP DOI BibTeX RDF
23	Kreshna Gopal, Tod D. Romo, James C. Sacchettini, Thomas R. Ioerger	Efficient retrieval of electron density patterns for modeling proteins by X-ray crystallography.	ICMLA	2004	DBLP DOI BibTeX RDF
23	Kreshna Gopal, Tod D. Romo, James C. Sacchettini, Thomas R. Ioerger	Weighting Features to Recognize 3D Patterns of Electron Density in X-Ray Protein Crystallography.	CSB	2004	DBLP DOI BibTeX RDF
23	Daniel N. Hennessy, Bruce G. Buchanan, John M. Rosenberg	XtalGrow: Probabilistic Screen Design for Protein Crystallography.	METMBS	2003	DBLP BibTeX RDF
23	Dylan Jayatilaka, Daniel J. Grimwood	Tonto: A Fortran Based Object-Oriented System for Quantum Chemistry and Crystallography.	International Conference on Computational Science	2003	DBLP DOI BibTeX RDF
23	Brian McMahon	An integrated web resource for crystallography.	Data Sci. J.	2002	DBLP DOI BibTeX RDF
23	Lulu Huang, Lou Massa, Jerome Karle	Quantum crystallography, a developing area of computational chemistry extending to macromolecules.	IBM J. Res. Dev.	2001	DBLP DOI BibTeX RDF
23	Veit Elser	Crystallography and Riemann Surfaces.	Discret. Comput. Geom.	2001	DBLP DOI BibTeX RDF
23	Sachiko Okada, Kenji Okada	Detailed Differential Coefficients of Anomalous Dispersion Terms to Derivatives in Least-squares Refinement for X-ray Crystallography.	Comput. Chem.	2000	DBLP DOI BibTeX RDF
23	Yibin Zheng, Peter C. Doerschuk, John E. Johnson	Symmetry-constrained 3-D interpolation of viral X-ray crystallography data.	IEEE Trans. Signal Process.	2000	DBLP DOI BibTeX RDF
23	Ying-Chieh Sun, Shu-Fen Yang, I-Lung Hwang, Tzu-Hsien Wu	A 500-ps molecular dynamics simulation trajectory of cardiotoxin II from Taiwan cobra venom in solution: Correlation with NMR and X-ray crystallography data.	J. Comput. Chem.	1999	DBLP DOI BibTeX RDF
23	Yibin Zheng, Peter C. Doerschuk, John E. Johnson	Symmetry-constrained 3D interpolation for virus X-ray crystallography.	ICASSP	1998	DBLP DOI BibTeX RDF
23	John C. Bollinger	Computer Modelling in Inorganic Crystallography. Edited by C. R. A. Catlow. Academic Press: San Diego, 1997, 340 pp. ISBN 0-12-164135-X.	J. Chem. Inf. Comput. Sci.	1997	DBLP DOI BibTeX RDF
23	Shankara Ramamurthy, Bryant W. York, Carmelo Giacovazzo	On the scalability of parallel triplet generation for protein crystallography.	SAC	1996	DBLP DOI BibTeX RDF
23	Jean Musso, Yoshitaka Beppu	NAMOD_CRYST: Version for Crystallography from NAMOD Computer Program for Drawing Ball-and-stick Molecular Models.	Comput. Chem.	1995	DBLP DOI BibTeX RDF
23	Herbert A. Hauptman	A minimal principle in the phase problem of X-ray crystallography.	Global Minimization of Nonconvex Energy Functions: Molecular Conformation and Protein Folding	1995	DBLP DOI BibTeX RDF