WinGX suite for small-molecule single-crystal crystallography

No abstract is available for this paper.

• Publication year

  1999

• Venue

  Journal of Applied Crystallography

• Publication date

  1999-08-01

• Fields of study

  Chemistry, Computer Science

• Identifiers
  DOI 10.1107/S0021889899006020
• External record

  Open on Semantic Scholar

• Source metadata

  Semantic Scholar

• No claims are published for this paper.

• No concepts are published for this paper.

• SIR97: a new tool for crystal structure determination and refinement

  1999cited by this paper
• ORTEP-3 for Windows - a version of ORTEP-III with a Graphical User Interface (GUI)

  1997cited by this paper
• Raster3D: photorealistic molecular graphics.

  1997cited by this paper
• An empirical correction for absorption anisotropy.

  1995cited by this paper
• RASMOL: biomolecular graphics for all.

  1995cited by this paper
• PARST95 – an update to PARST: a system of Fortran routines for calculating molecular structure parameters from the results of crystal structure analyses

  1995cited by this paper
• Completion and refinement of crystal structures with SIR92

  1993cited by this paper
• The crystallographic information file (CIF) : a new standard archive file for crystallography

  1991cited by this paper
• Some computer drawings of molecular and solid-state structures

  1989cited by this paper
• The GX crystallographic program system

  1985cited by this paper
• An empirical method for correcting diffractometer data for absorption effects

  1983cited by this paper
• Analysis of molecular motion with allowance for intramolecular torsion

  1978cited by this paper
• The Netherlands Source: Cbs/cheps Higher Education Monitor

  year unknowncited by this paper

• (E)-N'-(4-chlorobenzylidene)-5-methyl-1H-pyrazole-3-carbohydrazide as a potential PI3Kα targeting scaffold, synthesis, X-ray crystallography, DFT, molecular docking, molecular dynamics simulations, and MMGBSA analysis

  2026cites this paper
• Synthesis, Crystal Structure, and DFT Study of a Novel Quinoline-Based Schiff Base with Nonlinear Optical and Biological Potential

  2026cites this paper
• Crystal structure, spectroscopic characterization and antibacterial properties of an organic–inorganic hybrid salt (C₅H₆N₃O₂)₂[Cu(SO₄)₂(H₂O)₄]

  2026cites this paper
• Crystal structure, chemical composition, and twinning of götzenite and wöhlerite from the Fohberg phonolite, Kaiserstuhl

  2026cites this paper
• Synthesis, X-ray, molecular electronic property investigation, and molecular docking analysis of two imino Schiff bases

  2026cites this paper
• Nonlinear Optical Properties of Fe(II) and Ru(II) Alkynyl-Functionalized 1,3,5-Triphenyl-1,3,5-triazine-2,4,6-triones and 1,3,5-Triphenylbenzenes: Syntheses, Second-Harmonic Generation and Two-Photon Absorption

  2026cites this paper
• Revisiting Copper(II) Schiff Base Complexes of Halogenated Salicylaldehyde 8-Aminoquinoline Derivatives as Promising Antimicrobial Scaffolds: Improved Structural Data, Characterization and Insights into DNA/BSA Binding and ROS

  2026cites this paper
• Mono-, di-, and trinuclear cobalt(III) complexes with a H2salpn derivative: metal-assisted ligand transformation leading to the unusual formation of 2H-1,3-benzoxazine ring

  2026cites this paper
• Comprehensive analysis of a novel iron(III) bromide based organic-inorganic hybrid material: Structural, conduction mechanisms and magnetic properties studies

  2026cites this paper
• Structural diversity and bioactivity of antimony(III) complexes with 4-Methyl-1,2,4-triazole-3-thiol

  2026cites this paper
• Structure-property relationships in cubic Zr7Ru6+хGa17-x (0 ≤ x ≤ 2.0): disorder, electrical transport and bonding

  2026cites this paper
• Metal ion Catalysed Degradations of a Di-2-pyridyl ketone based Dihydrazone for Distinct Metal Complexes of Biological Potentials

  2026cites this paper
• Synthesis and characterization of [C5H10NH2]2PbCl4 compound through experimental and computational methods

  2026cites this paper
• Correlated structural, vibrational and dielectric properties of the [(C4H9)4N]2CoBr4 compound: origin of low-frequency polarization

  2026cites this paper
• Tin-based hybrid: from crystal engineering to sensitive Cd2+ detection in real water samples

  2026cites this paper
• New intergrowth compounds in the La-Co-Al system, La3Co5Al2, La6Co7Al7, and La4Co9.6Al3.4: crystal structures, bonding, and magnetism

  2025cites this paper
• Synthesis, Characterization, FTIR and UV-Vis of a Novel Compound (E)-3-(5-bromo-3-fluoro-2-hydroxybenzilide amino)Benzaldehyde

  2025cites this paper
• Characterization, structural study, Hirshfeld surface, vibrational properties and thermal analysis of a supramolecular hybrid compound: (C8H14N2)4·(TeBr6)3·2(Br)

  2025cites this paper
• A novel 1D Borotungstate Polymer: Structure and Biologic Activity

  2025cites this paper
• Cis and trans- phenanthroline glycolate oxomolybdenum(V) complexes: Syntheses, spectroscopic characterization, structures and their catalytic degradations of methyl orange

  2025cites this paper
• Synthesis of 1,4-DHP-Based Bio-Active Molecules by a pH-Stable Lewis Acidic Ni-MOF Catalyst.

  2025cites this paper
• 3-Amino-4-cyano-5-arylphthalimides: Synthesis, structures and photophysical properties

  2025cites this paper
• The crystal structure of 4-dimethylaminoantipyrine hydrochloride, C13H18N3OCl

  2025cites this paper
• Synthesis, spectral, crystal, docking, antioxidant, and anticancer studies of pyrazole Schiff bases

  2025cites this paper
• Crystal Engineering, Electronic Structure and Docking Study of bis(2-amino-6-methylpyridinium) Oxalate

  2025cites this paper
• Bioorganometallic tagging of N-acetylhistamine with an Fe(CO)3 unit: synthesis, X-ray structure, and protonation behavior

  2025influential citation
• Tri-nuclear Cd(II) complexes with diverse anionic residues: unique structures and Schottky device potential

  2025cites this paper
• Effect of azide co-ligand on the crystal structures of rhodium and iridium metal complexes featuring pyridine-based thiourea derivatives: Characterization and in vitro biological studies

  2025cites this paper
• Structural study, optical properties, thermal stability, and biological activity of a non-centrosymmetric hybrid compound 3,4-Diaminopyridinium perchlorate (3,4-DAPP)

  2025cites this paper
• Mechanochemical Reactivity of Ribonucleosides Mediated by Inorganic Species: Implications for Extraterrestrial Organic Matter Interpretation

  2025cites this paper
• Identification of a new polymorphic form of N-phenyl-2-(pyridin-4-ylcarbonyl)hydrazinecarboxamide: Structural insights by X-ray and quantum chemical calculations

  2025cites this paper
• A new monohydrazone-based fluorescent colorimetric optical chemosensor for selective and sensitive detection of Ni2+ in aqueous medium: Biological, environmental and logic gate application

  2025cites this paper
• One‐Pot Catalytic Syntheses of Quinazolinones by Coupling of 2‐Aminobenzamide With Primary Alcohols Using a Nickel(II)‐ONO Pincer‐Like Complex

  2025cites this paper
• Synthesis, Characterization, Structural Analysis, Hirshfeld Surface Studies, and Molecular Docking of 1,3,5-Tris(p-bromophenyl)-1,3,5-Triazacyclohexane

  2025cites this paper
• The superconducting diode effect in Josephson junctions fabricated from structurally chiral Mo$_3$Al$_2$C

  2025cites this paper
• A new 3D ionic lanthanide coordination polymer induced by hydrolysis of N,N-dimethylformamide via solvothermal reaction

  2025cites this paper
• Deciphering the Magnetostructural Criteria in DyIII and HoIII Macrocycle-Based Single-Molecule Magnets with Pseudo‑D 5h Symmetry: A Combined Single-Crystal Hysteresis and Theoretical Study

  2025cites this paper
• Synthesis, Spectroscopic, Hirshfeld Surface analysis, electronic and Z-Scan analysis of 4-bromobenzylidene picolinohydrazide (4BBPH): Experimental and computational study

  2025cites this paper
• Green Synthesis, Characterization, and Therapeutic Potential of 2-(Thiophen-2-ylmethylene)malononitrile: Insights into Molecular Interactions with Cyclooxygenase-2 (COX-2)

  2025cites this paper
• Structural, optical and biological characterization of a new cobalt-based mixed halide hybrid compound: insights from DFT and vibrational analysis

  2025cites this paper
• Design, X-ray crystal structure, Hirshfeld surface analysis, In vitro biological evaluation, DFT and molecular docking studies of 3,4,5-trimethoxyphenyl α-acetoxymethyl phosphonates

  2025cites this paper
• A novel copper chelate complex for advanced oxidation: Synthesis, crystal structure, stability, and catalytic efficiency

  2025cites this paper
• Crystal Structure, DFT-Guided Design, and Selective Antibacterial Activity of a Calcium-Based Hybrid for Spray Coating Applications

  2025cites this paper
• Cleavage of N N and coupling of C N double bonds by a quintuply bonded chromium dimer

  2025cites this paper
• A Heterobimetallic Au(I)–Ru(II) Complex Bridged by dppb: Synthesis, Structural and Solution Characterization, BSA Interaction and In Vivo Toxicity Evaluation in Wistar Rats

  2025cites this paper
• The crystal structure of the co-crystal isonicotinamide – 2-(nitrophenyl)methanol (1/1), C6H6N2O·C7H7NO3

  2025cites this paper
• A two-dimensional mixed ligands based coordination polymer of cadmium: Synthesis, single crystal structure and luminescence quenching based sensing behaviors towards Fe3+, Cr3+, Al3+ ions and TNP in aqueous phase

  2025cites this paper
• Facile C–H Bond Activation of 2-Ethylmercaptobenzothiazole in a Tri-Osmium Carbonyl Cluster: Crystal Structure of Os3(CO)10(µ-H){µN,C-NC(SC2H5)SC6H3}

  2025cites this paper
• Co-crystallization of isonicotinamide with diphenic acid: formation of a supramolecular adduct

  2025cites this paper
• A Theoretical and Spectroscopic Conformational Study of 3-Aminothiolane-3-Carboxylic Acid Dipeptide Derivatives

  2025cites this paper
• Crystal Structure and Solid State Assembly Inspection by Hirshfeld Surface Analysis of the Imidazole-Based Ligand

  2025cites this paper
• Molecular Rotors of BOSCHIBAs Derived From α‐Amino Acids as Fluorescent Target of Gram‐Positive Bacteria

  2025cites this paper
• Structural nature of pyroelectric effect revisited: Experimental and theoretical studies of synthetic Ni,Al - rich tourmaline

  2025cites this paper
• Synthesis and antibacterial evaluation of a unique amide library based on the marine natural product 3,5-dibromo-4-methoxybenzoic acid

  2025cites this paper
• Fluorescence turn ON/OFF fluorophore- quencher complexes (Zn2+/Fe2+) of 2,3-dihydro-4-hydroxy-chromene Schiff base as chemosensor, live cellimaging (in vitro/ in vivo), DFT studiesand proficient cytotoxic agents

  2025cites this paper
• Exploring the structural, vibrational, thermal, and nonlinear optical properties of a novel Cu(II) complex of 6-fluoro-pyridine-2-carboxylic acid

  2025cites this paper
• Supramolecular Organization and Optical Properties of Nanoscale and Microscale Films of an Anisometric Europium(III) Complex

  2025cites this paper
• Crystal structure of 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid dimethyl sulfoxide monosolvate, C4H2N3O4⋅C2H6OS

  2025cites this paper
• Synthesis, physicochemical characterization, and crystal structures of Ni(II) and Cu(II) sulfadiazine and 2,2’-bipyridine complexes. Pharmacological assessment of related compounds

  2025cites this paper
• Investigation of ultra-wide bandgap chloro-perovskite materials for blue LED applications: Crystal structure, optical and DFT studies

  2025cites this paper
• Crystal structure, thermal behavior, electric and dielectric properties of a novel organic–inorganic hybrid compound based on iron (III) chloride

  2025cites this paper
• Deep-red emitting neutral Ir(III) complexes possessing rigid bidentate ligand and various ancillaries

  2025cites this paper
• Compression of Molybdenum Blue Polyoxometalate Cluster Rings

  2025cites this paper
• Synthesis, structural, spectral, thermal, and nonlinear optical properties study of curcumin based organic single crystal:1-(4-chlorobenzoyl)-3,5-bis((E)-2,4,5-trimethoxybenzylidene) piperidin-4-one

  2025cites this paper
• Synthesis and Antileishmanial Evaluation of N-Phenyl-2-phenoxyacetamides Derived from Carvacrol

  2025cites this paper
• Synthesis, crystal structure, computational and solution studies of a new phosphotetradecavanadate salt. Assessment of its effect on U87 glioblastoma cells.

  2025cites this paper
• Lithium and Chromium Complexes of a Bulky Guanidinate – Synthesis and Structure

  2025cites this paper
• Laueite/stewartite epitaxy – a single-crystal diffraction study

  2025cites this paper
• Lanthanoid Coordination Polymers Based on Homoditopic Picolinate Ligands: Synthesis, Structure and Magnetic Properties

  2025cites this paper
• Sol-Gel Heterogeneization of an Ir(III) Complex for Sustainable Visible-Light Redox Photocatalysis

  2025cites this paper
• Oxidative addition of diaryldichalcogenides to the diferrocenylphosphenium ion: synthesis, structure and organocatalytic activity.

  2025cites this paper
• Novel organoruthenium complexes containing β-Diketonates: Synthesis, characterization, DNA/HSA interactions, and the impact of biocompatible ionic liquids on biological activities.

  2025cites this paper
• Unveiling the Supramolecular Properties, DFT Optimization, and Molecular Docking Studies against SARS-CoV-2 Proteins of a 2,6-Bis(benzimidazol-2-yl)pyridine

  2025cites this paper
• Significant anharmonic scattering in single-crystalline Mg4.8Ag1.4Sb4 with site-occupation disorders

  2025cites this paper
• Fluorometric Detection of Sodium Ion Using Bis(2,4-dihydroxyphenylmethylene)Thiocarbohydrazone; Crystal Structure, DFT Studies, Anti-Cancer Assay, ADMET Study and Molecular Docking

  2025cites this paper
• Synthesis, Crystal Structure, Hirshfeld Surface Analysis, DFT Calculations, Molecular Docking, MD Simulations, ADMET and Anti-breast Cancer Assessment of New 2-Phenylindole Linked 1,2,4-Oxadiazole Derivatives

  2025cites this paper
• Competition between Photoswitching and Fluorescence in Hemiindigos and Hemithioindigos.

  2025cites this paper
• Synthesis, characterization, and anticancer potential of some 2,4-diketo esters containing dehydrozingerone fragment: DNA and protein binding study and molecular docking

  2025cites this paper
• Tuning structure and magnetic order through Cr substitution in Co3O2BO3 Ludwigite

  2025cites this paper
• Synthesis, Structural Analysis, Computational Investigation, and Cytotoxicity Studies of New Copper(II) Coordination Polymers

  2025cites this paper
• Growth and Different Characterization Studies of Nonlinear Optical Material L-Isoleucinium Hydrogen Maleate Hemihydrate for Technological Applications

  2025cites this paper
• Emergence of conformational diversity and complexity of supramolecular structure by the interaction of a simple molecule with a uniform surface

  2025cites this paper
• Synthesis, crystal structure, and electrochemical properties of 5-benzoyl-6-phenyl-pyrimidin-4-one-2-thione compound; voltammetric, spectrophotometric, and molecular docking studies of its interaction with DNA

  2025cites this paper
• Shrinking of C-S bonds of organosulfonic acids in superacidic media-investigation of the protonation of methanesulfonic acid and benzenesulfonic acid and their limits.

  2025cites this paper
• Wiperamingaite, NaCaFe3+Al(PO4)F5(OH)·H2O, a new mineral from Wiperaminga Hill, South Australia, Australia

  2025cites this paper
• Isolation of kinetically-stabilised diarylchalcogenide radical cations

  2025cites this paper
• Dielectric and electrical characteristics of a zinc-based hybrid mixed halide material for energy harvesting applications

  2025cites this paper
• A new Co-substituted aluminophosphate (CoAPO-14): crystal structure and thermal behaviour by in situ single crystal X-ray diffraction

  2025cites this paper
• Structure–property relationships in tris(2-amino-5-methylpyridinium) hexabromobismuthate monohydrate with a focus on optical and electrical behavior for optoelectronics applications

  2025cites this paper
• Vanadium(IV) complexes of acetophenone isoniazid hydrazones: Synthesis, characterization, stability assay, antidiabetic activity, histopathology and bioaccumulation.

  2025cites this paper
• Structural Characteristics of Homoleptic Zinc Complexes Incorporating Asymmetric Aminopyridinates

  2025cites this paper
• New spirooxindole-benzothiazole hybrids incorporating a trifluoromethyl moiety as antiviral agents: Design, synthesis, crystal structure analysis, and in silico studies

  2025cites this paper
• Synthesis of new asymmetrical frame phosphonates based on Sesamol

  2025cites this paper
• In Situ High-Temperature and High-Pressure Spectroscopic Study of the Thermal and Pressure Behavior of Hydrous Fe-Rich Ringwoodite

  2025cites this paper
• Fluormacraeite, [(H2O)K]Mn2(Fe2Ti)(PO4)4[OF](H2O)10  ⋅  4H2O, the first type mineral from the Plößberg pegmatite, Upper Palatinate, Bavaria, Germany

  2025cites this paper
• Synthesis, Characterization, Antibacterial Activity, and Molecular Docking of a Furan-Based Schiff Base Molybdenum(VI) Dioxo Complex

  2025cites this paper
• Hybrid Silica Materials Functionalized with Chloroxine-Based Metal Complexes: Exploring Synergistic Antibacterial Activity

  2025cites this paper
• Crystal Structure, Spectroscopic (FT-IR and UV-Vis), Nonlinear Optical, and Molecular Docking Analyses of a Fluorinated Picolinate Silver(I) Complex

  2025cites this paper
• Sodium salt of boron-substituted first keggin-type polyoxometalate; synthesis, crystal structure and investigation of antimicrobial activities

  2025cites this paper
• Mono(guanidinate) chromium(II) chloride complexes: Selective synthesis and structural characterization

  2025cites this paper