Staff profile
Overview

Affiliation | Telephone |
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Professor in Practice, Geometry in the Department of Mathematical Sciences | |
Professor in Practice in the Department of Chemistry |
Publications
Journal Article
- Effect of ruthenium(II) complexes on MDA-MB-231 cells and lifespan/tumor growth in gld-1mutant, Daf-16 TF and stress productive genes: A perspective study.
Nandhini, S., Thiruppathi, G., Ranjani, M., Puschmann, H., Ravi, M., Sundararaj, P., & Prabhakaran, R. (2024). Effect of ruthenium(II) complexes on MDA-MB-231 cells and lifespan/tumor growth in gld-1mutant, Daf-16 TF and stress productive genes: A perspective study. Journal of Inorganic Biochemistry, 257, Article 112580. https://doi.org/10.1016/j.jinorgbio.2024.112580 - Refinement of anomalous dispersion correction parameters in single-crystal structure determinations
Meurer, F., Dolomanov, O. V., Hennig, C., Peyerimhoff, N., Kleemiss, F., Puschmann, H., & Bodensteiner, M. (2022). Refinement of anomalous dispersion correction parameters in single-crystal structure determinations. IUCrJ, 9(5), https://doi.org/10.1107/s2052252522006844 - The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges
Meurer, F., von Essen, C., Kühn, C., Puschmann, H., & Bodensteiner, M. (2022). The benefits of Cu Kβ radiation for the single-crystal X-ray structure determination of crystalline sponges. IUCrJ, 9(3), https://doi.org/10.1107/s2052252522002147 - Vanishing of the atomic form factor derivatives in non-spherical structural refinement – a key approximation scrutinized in the case of Hirshfeld atom refinement
Midgley, L., Bourhis, L. J., Dolomanov, O. V., Grabowsky, S., Kleemiss, F., Puschmann, H., & Peyerimhoff, N. (2021). Vanishing of the atomic form factor derivatives in non-spherical structural refinement – a key approximation scrutinized in the case of Hirshfeld atom refinement. Acta Crystallographica Section A: Foundations and Advances, 77(6), 519-533. https://doi.org/10.1107/s2053273321009086 - Structural and antioxidant properties of guanylhydrazinium pyrazine-2-carboxylate
Packiaraj, S., Kousalya, L., Pushpaveni, A., Poornima, S., Puschmann, H., & Govindarajan, S. (2021). Structural and antioxidant properties of guanylhydrazinium pyrazine-2-carboxylate. Journal of Materials Science: Materials in Electronics, 32(6), 7704-7718. https://doi.org/10.1007/s10854-021-05489-2 - Accurate Crystal Structures and Chemical Properties from NoSpherA2
Kleemiss, F., Dolomanov, O. V., Bodensteiner, M., Peyerimhoff, N., Midgley, L., Bourhis, L. J., Genoni, A., Malaspina, L. A., Jayatilaka, D., Spencer, J. L., White, F., Grundkötter-Stock, B., Steinhauer, S., Lentz, D., Puschmann, H., & Grabowsky, S. (2021). Accurate Crystal Structures and Chemical Properties from NoSpherA2. Chemical Science, 12, 1675-1692. https://doi.org/10.1039/d0sc05526c - A binuclear chloride bridged Cu(II) and a mononuclear Ni(II) complex: Synthesis, crystal structure, photo catalytic and biological studies
Jana, K., Maity, R., Puschmann, H., Mitra, A., Ghosh, R., Debnath, S. C., Shukla, A., Mahanta, A. K., Maity, T., & Samanta, B. C. (2021). A binuclear chloride bridged Cu(II) and a mononuclear Ni(II) complex: Synthesis, crystal structure, photo catalytic and biological studies. Inorganica Chimica Acta, 515, Article 120067. https://doi.org/10.1016/j.ica.2020.120067 - Bidentate Schiff base coordinated square planer nickel(II) complexes: Synthesis, crystal structure, DFT/TD-DFT calculation and DNA/protein binding
Patra, A., Puschmann, H., & Manna, S. C. (2021). Bidentate Schiff base coordinated square planer nickel(II) complexes: Synthesis, crystal structure, DFT/TD-DFT calculation and DNA/protein binding. Polyhedron, 201, Article 115146. https://doi.org/10.1016/j.poly.2021.115146 - Teaching a large-scale crystallography school with Zoom Webinar
Ferrara, J. D., Cochran, A., Del Campo, M., Gob, C. R., Le Magueres, P., Meyer, M., Puschmann, H., Schurmann, C., Stanley, A., Swepston, P. N., Tripathi, A., White, F., & Wojciechowski, J. (2021). Teaching a large-scale crystallography school with Zoom Webinar. Structural Dynamics, 8(1), Article 010401. https://doi.org/10.1063/4.0000078 - Synthesis and crystal structure of N,N `-bis(4-chlorophenyl)thiourea N,N-dimethylformamide
Odularu, A. T., Ajibade, P. A., Oyedeji, O. O., Mbese, J. Z., & Puschmann, H. (2021). Synthesis and crystal structure of N,N `-bis(4-chlorophenyl)thiourea N,N-dimethylformamide. Open Chemistry Journal, 19(1), 511-517. https://doi.org/10.1515/chem-2020-0061 - Two 1D Silver(I) Coordination Polymers with 1,3-Bis(4-pyridyl) propane and Aromatic Carboxylate Anions: Synthesis, Structure and Photocatalytic Behavior
Kulovi, S., Nandi, L., Puschmann, H., Zangrando, E., & Dalai, S. (2021). Two 1D Silver(I) Coordination Polymers with 1,3-Bis(4-pyridyl) propane and Aromatic Carboxylate Anions: Synthesis, Structure and Photocatalytic Behavior. ChemistrySelect, 6(34), 8950-8958. https://doi.org/10.1002/slct.202102197 - Polymorphism in [Ag(bpetan)](n) Coordination Polymers with Nitrate and Isophthalate Anions: Photocatalytic and Antibacterial Activity, Hemolysis Assay and Study of Cytotoxicity
Kulovi, S., Pradhan, A., (Choudhury), S. M., Puschmann, H., Zangrando, E., & Dalai, S. (2020). Polymorphism in [Ag(bpetan)](n) Coordination Polymers with Nitrate and Isophthalate Anions: Photocatalytic and Antibacterial Activity, Hemolysis Assay and Study of Cytotoxicity. ChemistrySelect, 5(11), 3337-3346. https://doi.org/10.1002/slct.202000291 - Nano spinel cobaltites and their catalytic and electrochemical properties: facile synthesis of metal (Co, Ni, and Zn) and mixed metal (Co-Ni and Co-Zn) complexes of Schiff bases prepared from alpha-ketoglutaric acid and ethyl carbazate
Parveen, S., Nguyen, H. H., Premkumar, T., Puschmann, H., & Govindarajan, S. (2020). Nano spinel cobaltites and their catalytic and electrochemical properties: facile synthesis of metal (Co, Ni, and Zn) and mixed metal (Co-Ni and Co-Zn) complexes of Schiff bases prepared from alpha-ketoglutaric acid and ethyl carbazate. New Journal of Chemistry, 44(29), 12729-12740. https://doi.org/10.1039/d0nj01016b - Field-induced slow magnetic relaxation in mixed valence di- and tri-nuclear Co-II-Co(III )complexes
Paul, A., Viciano-Chumillas, M., Puschmann, H., Cano, J., & Manna, S. C. (2020). Field-induced slow magnetic relaxation in mixed valence di- and tri-nuclear Co-II-Co(III )complexes. Dalton Transactions, 49(27), 9516-9528. https://doi.org/10.1039/d0dt00588f - Supramolecular Self-Assembly, DNA interaction, Antibacterial and Cell Viability studies of Cu(II) and Ni(II) Complexes derived from NNN donor Schiff Base ligand
Jana, K., Das, S., Puschmann, H., Debnath, S. C., Shukla, A., Mahanta, A. K., Hossain, M., Maity, T., & Samanta, B. C. (2019). Supramolecular Self-Assembly, DNA interaction, Antibacterial and Cell Viability studies of Cu(II) and Ni(II) Complexes derived from NNN donor Schiff Base ligand. Inorganica Chimica Acta, 487, 128-137. https://doi.org/10.1016/j.ica.2018.12.007 - OLEX2: TEACHING NEW SOFTWARE OLD AND NEW TRICKS
Puschmann, H., & Dolomanov, O. (2019). OLEX2: TEACHING NEW SOFTWARE OLD AND NEW TRICKS. Acta Crystallographica Section A: Foundations and Advances, 75, https://doi.org/10.1107/s2053273319087904 - Double mu(2)-(phenoxido)-bridged dinuclear and polynuclear nickel(II) complexes: Magnetic properties and DNA/protein interaction
Paul, A., Figuerola, A., Puschmann, H., & Manna, S. C. (2019). Double mu(2)-(phenoxido)-bridged dinuclear and polynuclear nickel(II) complexes: Magnetic properties and DNA/protein interaction. Polyhedron, 157, 39-48. https://doi.org/10.1016/j.poly.2018.09.023 - Tetranuclear Schiff base copper(II) complexes: Syntheses, crystal structure, DNA/protein binding and catecholase-like activity
Manna, S., Zangrando, E., Puschmann, H., & Manna, S. C. (2019). Tetranuclear Schiff base copper(II) complexes: Syntheses, crystal structure, DNA/protein binding and catecholase-like activity. Polyhedron, 162, 285-292. https://doi.org/10.1016/j.poly.2019.01.057 - Synthesis, structure, DNA/protein binding, molecular docking and in vitro anticancer activity of two Schiff base coordinated copper(II) complexes
Manna, S. C., Mistri, S., Patra, A., Mahish, M. K., Saren, D., Manne, R. K., Santra, M. K., Zangrando, E., & Puschmann, H. (2019). Synthesis, structure, DNA/protein binding, molecular docking and in vitro anticancer activity of two Schiff base coordinated copper(II) complexes. Polyhedron, 171, 77-85. https://doi.org/10.1016/j.poly.2019.06.049 - Synthesis, crystal structure and DNA/protein binding of tetranuclear Cu(II) complexes with a double-open-cubane like core framework
Paul, A., Puschmann, H., & Manna, S. C. (2018). Synthesis, crystal structure and DNA/protein binding of tetranuclear Cu(II) complexes with a double-open-cubane like core framework. Polyhedron, 155, 447-456. https://doi.org/10.1016/j.poly.2018.08.020 - Accurate hydrogen atom positions from standard X-ray Data: hirshfeld atom refinement and Olex2
Puschmann, H., & Dolomanov, O. (2018). Accurate hydrogen atom positions from standard X-ray Data: hirshfeld atom refinement and Olex2. Acta Crystallographica Section A: Foundations and Advances, 74(S), https://doi.org/10.1107/s2053273318094603 - Trimerisation of carbon suboxide at a di-titanium centre to form a pyrone ring system
Tsoureas, N., Green, J. C., Cloke, F. G. N., Puschmann, H., Roe, S. M., & Tizzard, G. (2018). Trimerisation of carbon suboxide at a di-titanium centre to form a pyrone ring system. Chemical Science, 9(22), 5008-5014. https://doi.org/10.1039/c8sc01127c - Synthesis, Crystal structure and Biological studies of New Hydrazone ligand, 2-(Methoxycarbonyl-hydrazono)-pentanedioic acid and its Silver(I) complex
Parveen, S., Govindarajan, S., Puschmann, H., & Revathi, R. (2018). Synthesis, Crystal structure and Biological studies of New Hydrazone ligand, 2-(Methoxycarbonyl-hydrazono)-pentanedioic acid and its Silver(I) complex. Inorganica Chimica Acta, 477, 66-74. https://doi.org/10.1016/j.ica.2018.02.022 - Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2
Fugel, M., Jayatilaka, D., Hupf, E., Overgaard, J., Hathwar, V. R., Macchi, P., Turner, M. J., Howard, J. A., Dolomanov, O. V., Puschmann, H., Iversen, B. B., Bürgi, H.-B., & Grabowsky, S. (2018). Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2. IUCrJ, 5(1), 32-44. https://doi.org/10.1107/s2052252517015548 - Hemocompatible 3D Silver(I) Coordination Polymers: Synthesis, X-ray Structure, Photo-Catalytic and Antibacterial Activity
Kulovi, S., Dalbera, S., Dey, S. K., Maiti (Choudhury), S., Puschmann, H., Zangrando, E., & Dalai, S. (2018). Hemocompatible 3D Silver(I) Coordination Polymers: Synthesis, X-ray Structure, Photo-Catalytic and Antibacterial Activity. ChemistrySelect, 3(18), 5233-5242. https://doi.org/10.1002/slct.201800642 - DNA/Protein Binding, Molecular Docking and Cytotoxicity Studies of Piperazinyl-Moiety-Based Copper(II) Complexes
Mistri, S., Patra, A., Santra, M. K., Paul, D., Zangrando, E., Puschmann, H., & Manna, S. C. (2018). DNA/Protein Binding, Molecular Docking and Cytotoxicity Studies of Piperazinyl-Moiety-Based Copper(II) Complexes. ChemistrySelect, 3(31), 9102-9112. https://doi.org/10.1002/slct.201801757 - 11-Azaartemisinin cocrystals with preserved lactam : acid heterosynthons
Nisar, M., Sung, H. H. .-Y., Puschmann, H., Lakerveld, R., Haynes, R. K., & Williams, I. D. (2018). 11-Azaartemisinin cocrystals with preserved lactam : acid heterosynthons. CrystEngComm, 20(9), 1205-1219. https://doi.org/10.1039/c7ce01875d - Discrete and 1D Polymeric Copper(II) Complexes of Tetranuclear Cubane-like Units: Structural and Magnetic Characterization
Manna, S. C., Manna, S., Mistri, S., Patra, A., Zangrando, E., Puschmann, H., Goddard, P., & Ghannadzadeh, S. (2018). Discrete and 1D Polymeric Copper(II) Complexes of Tetranuclear Cubane-like Units: Structural and Magnetic Characterization. ChemistrySelect, 3(34), 9885-9891. https://doi.org/10.1002/slct.201801677 - Single-Ion Magnetic Behavior in Co-II-Co-III Mixed-Valence Dinuclear and Pseudodinuclear Complexes
Manna, S., Bhunia, A., Mistri, S., Vallejo, J., Zangrando, E., Puschmann, H., Cano, J., & Manna, S. C. (2017). Single-Ion Magnetic Behavior in Co-II-Co-III Mixed-Valence Dinuclear and Pseudodinuclear Complexes. European Journal of Inorganic Chemistry, 2017(19), 2585-2594. https://doi.org/10.1002/ejic.201700046 - The effect of incorporating carboxylic acid functionalities into 2,2 `-bipyridine on the biological activity of the complexes formed: synthesis, structure, DNA/protein interaction, antioxidant activity and cytotoxicity
Kamatchi, T. S., Chitrapriya, N., Kumar, S. L. A., Jung, J. Y., Puschmann, H., Fronczek, F. R., & Natarajan, K. (2017). The effect of incorporating carboxylic acid functionalities into 2,2 `-bipyridine on the biological activity of the complexes formed: synthesis, structure, DNA/protein interaction, antioxidant activity and cytotoxicity. RSC Advances, 7(27), 16428-16443. https://doi.org/10.1039/c7ra00425g - New Silver(I) Coordination Polymers with Hetero Donor Ligands: Synthesis, Structure, Luminescence Study and Photo-Catalytic Behavior
Kulovi, S., Dalbera, S., Das, S., Zangrando, E., Puschmann, H., & Dalai, S. (2017). New Silver(I) Coordination Polymers with Hetero Donor Ligands: Synthesis, Structure, Luminescence Study and Photo-Catalytic Behavior. ChemistrySelect, 2(28), 9029-9036. https://doi.org/10.1002/slct.201701697 - The Many Faces of Olex2
Puschmann, H., & Dolomanov, O. (2017). The Many Faces of Olex2. Acta Crystallographica Section A: Foundations and Advances, 73(S), https://doi.org/10.1107/s0108767317098373 - Synthesis, Characterization and Crystal Structure of a New 3D Cadmium(II) Coordination Polymer: Binding Interaction with DNA and Double Stranded RNA
Jana, S. K., Mandal, A. K., Seth, S. K., Puschmann, H., Hossain, M., & Dalai, S. (2016). Synthesis, Characterization and Crystal Structure of a New 3D Cadmium(II) Coordination Polymer: Binding Interaction with DNA and Double Stranded RNA. Journal of Inorganic and Organometallic Polymers and Materials, 26(4), 806-818. https://doi.org/10.1007/s10904-016-0383-x - 1D lead(II) coordination chains with carboxylate containing ligands. A rare example of polyrotaxane 1D -> 1D interpenetrated coordination polymer
Hazari, D., Jana, S. K., Puschmann, H., Zangrando, E., & Dalai, S. (2016). 1D lead(II) coordination chains with carboxylate containing ligands. A rare example of polyrotaxane 1D -> 1D interpenetrated coordination polymer. Inorganic Chemistry Communications, 65, 1-3. https://doi.org/10.1016/j.inoche.2016.01.003 - DNA/protein binding, cytotoxicity and catecholase activity studies of a piperazinyl moiety ligand based nickel(II) compleX
Mistri, S., Puschmann, H., & Manna, S. C. (2016). DNA/protein binding, cytotoxicity and catecholase activity studies of a piperazinyl moiety ligand based nickel(II) compleX. Polyhedron, 115, 155-163. https://doi.org/10.1016/j.poly.2016.05.003 - Sensing of tryptophan by a non-toxic cobalt(II) complex
Jana, S. K., Mandal, A. K., Kumar, A., Puschmann, H., Hossain, M., & Dalai, S. (2016). Sensing of tryptophan by a non-toxic cobalt(II) complex. RSC Advances, 6(98), 95888-95896. https://doi.org/10.1039/c6ra16086g - Synthesis, crystal structure, DFT/TDDFT calculation, photophysical properties and DNA binding studies of morpholino moiety ligand based two Cu(II) complexes in combination with carboxylates
Paul, A., Mistri, S., Bhunia, A., Manna, S., Puschmann, H., & Manna, S. C. (2016). Synthesis, crystal structure, DFT/TDDFT calculation, photophysical properties and DNA binding studies of morpholino moiety ligand based two Cu(II) complexes in combination with carboxylates. RSC Advances, 6(65), 60487-60501. https://doi.org/10.1039/c6ra05570b - Structural variability of Ag(I) metal-organic networks: C-H and metal interactions
Hazari, D., Jana, S. K., Seth, S. K., Puschmann, H., & Dalai, S. (2016). Structural variability of Ag(I) metal-organic networks: C-H and metal interactions. Journal of Coordination Chemistry, 69(3), 562-573. https://doi.org/10.1080/00958972.2015.1135909 - A combined experimental and theoretical investigation on the Cu(II) sensing behavior of a piperazinyl moiety based ligand, and catecholase and biological activities of its Cu(II) complex in combination with pyridine 2,5-dicarboxylate
Mistri, S., Paul, A., Bhunia, A., Manne, R. K., Santra, M. K., Puschmann, H., & Manna, S. C. (2016). A combined experimental and theoretical investigation on the Cu(II) sensing behavior of a piperazinyl moiety based ligand, and catecholase and biological activities of its Cu(II) complex in combination with pyridine 2,5-dicarboxylate. Polyhedron, 104, 63-72. https://doi.org/10.1016/j.poly.2015.11.030 - Three manganese(II) coordination polymers with mixed donor ligands: synthesis, X-ray structures and luminescence properties
Hazari, D., Jana, S. K., Puschmann, H., Zangrando, E., & Dalai, S. (2015). Three manganese(II) coordination polymers with mixed donor ligands: synthesis, X-ray structures and luminescence properties. Transition Metal Chemistry, 40(6), 595-604. https://doi.org/10.1007/s11243-015-9952-z - Three New Co-ordination Polymers of Zinc(II) and Cadmium(II) with Dicarboxylate and Bipyridine Ligands: Synthesis, Structure and Luminescence Study
Hazari, D., Jana, S. K., Puschmann, H., Zangrando, E., & Dalai, S. (2015). Three New Co-ordination Polymers of Zinc(II) and Cadmium(II) with Dicarboxylate and Bipyridine Ligands: Synthesis, Structure and Luminescence Study. Journal of Inorganic and Organometallic Polymers and Materials, 25(5), 1151-1159. https://doi.org/10.1007/s10904-015-0223-4 - The anatomy of a comprehensive constrained, restrained refinement program for the modern computing environment-Olex2 dissected
Bourhis, L. J., Dolomanov, O. V., Gildea, R. J., Howard, J. A., & Puschmann, H. (2015). The anatomy of a comprehensive constrained, restrained refinement program for the modern computing environment-Olex2 dissected. Acta Crystallographica Section A: Foundations and Advances, 71(1), 59-75. https://doi.org/10.1107/s2053273314022207 - Olex2 and IYCr OpenLabs
Puschmann, H., & Dolomanov, O. (2015). Olex2 and IYCr OpenLabs. Acta Crystallographica Section A: Foundations and Advances, 71(S), https://doi.org/10.1107/s2053273315092219 - Electrical conductivity and luminescence properties of two silver(l) coordination polymers with heterocyclic nitrogen ligands
Rana, A., Jana, S. K., Pal, T., Puschmann, H., Zangrando, E., & Dalai, S. (2014). Electrical conductivity and luminescence properties of two silver(l) coordination polymers with heterocyclic nitrogen ligands. Journal of Solid State Chemistry, 216, 49-55. https://doi.org/10.1016/j.jssc.2014.04.026 - Sensing of Zn(2+)ion by N-Furfurylsalicylaldimine Based on CHEF Process
Jana, S. K., Bera, M., Puschmann, H., & Dalai, S. (2014). Sensing of Zn(2+)ion by N-Furfurylsalicylaldimine Based on CHEF Process. Journal of Fluorescence, 24(4), 1245-1251. https://doi.org/10.1007/s10895-014-1407-y - Synthesis and X-ray structure of a new zinc(II) coordination polymer: interaction with DNA and double stranded RNA and elucidation of the molecular aspects of the binding to bovine serum albumin
Jana, S. K., Seth, S. K., Puschmann, H., Hossain, M., & Dalai, S. (2014). Synthesis and X-ray structure of a new zinc(II) coordination polymer: interaction with DNA and double stranded RNA and elucidation of the molecular aspects of the binding to bovine serum albumin. RSC Advances, 4(101), 57855-57868. https://doi.org/10.1039/c4ra06588c - Bis(2-Hydroxy-3-Isopropyl-6-Methyl-Benzaldehyde)Ethylenediamine: A Novel Cation Sensor
Kuwar, A. S., Fegade, U. A., Tayade, K. C., Patil, U. D., Puschmann, H., Gite, V. V., Dalal, D. S., & Bendre, R. S. (2013). Bis(2-Hydroxy-3-Isopropyl-6-Methyl-Benzaldehyde)Ethylenediamine: A Novel Cation Sensor. Journal of Fluorescence, 23(5), 859-864. https://doi.org/10.1007/s10895-013-1223-9 - 2D and 1D Coordination Polymers of Ag(I) Ions with 2,6-Naphthalenedicarboxylate and N-Donor Coligands
Bera, M., Jana, S. K., Hazari, D., Rana, A., Chowdhuri, D. S., Puschmann, H., Zangrando, E., & Dalai, S. (2013). 2D and 1D Coordination Polymers of Ag(I) Ions with 2,6-Naphthalenedicarboxylate and N-Donor Coligands. Journal of Inorganic and Organometallic Polymers and Materials, 23(2), 325-332. https://doi.org/10.1007/s10904-012-9780-y - Very bright europium complexes that stain cellular mitochondria.
Walton, J., Bourdoll, A., Butler, S., Soulie, M., Delbianco, M., McMahon, B., Pal, R., Puschmann, H., Zwier, J., Lamarque, L., Maury, O., Andraud, C., & Parker, D. (2013). Very bright europium complexes that stain cellular mitochondria. Chemical Communications, 49(16), 1600-1602. https://doi.org/10.1039/c2cc35247h - A New 3D Silver(I) Coordination Polymer with Octadentate Diglycolate Ligand Having Silver-Silver Bond
Bera, M., Rana, A., Chowdhuri, D. S., Hazari, D., Jana, S. K., Puschmann, H., & Dalai, S. (2012). A New 3D Silver(I) Coordination Polymer with Octadentate Diglycolate Ligand Having Silver-Silver Bond. Journal of Inorganic and Organometallic Polymers and Materials, 22(5), 1074-1080. https://doi.org/10.1007/s10904-012-9685-9 - Three-Dimensional Silver(I)-Thiodiglycolate Coordination Polymer with Weak Ag-Ag Bond
Bera, M., Rana, A., Chowdhuri, D. S., Hazari, D., Jana, S. K., Puschmann, H., & Dalai, S. (2012). Three-Dimensional Silver(I)-Thiodiglycolate Coordination Polymer with Weak Ag-Ag Bond. Journal of Inorganic and Organometallic Polymers and Materials, 22(4), 897-902. https://doi.org/10.1007/s10904-012-9664-1 - 3D Silver(I)-Diglycolate Coordination Polymer with Short Ag-Ag Bond
Bera, M., Rana, A., Chowdhuri, D. S., Hazari, D., Puschmann, H., & Dalai, S. (2012). 3D Silver(I)-Diglycolate Coordination Polymer with Short Ag-Ag Bond. Journal of Inorganic and Organometallic Polymers and Materials, 22(1), 244-252. https://doi.org/10.1007/s10904-011-9562-y - iotbx.cif: a comprehensive CIF toolbox
Gildea, R. J., Bourhis, L. J., Dolomanov, O. V., Grosse-Kunstleve, R. W., Puschmann, H., Adams, P. D., & Howard, J. A. (2011). iotbx.cif: a comprehensive CIF toolbox. Journal of Applied Crystallography, 44(6), 1259-1263. https://doi.org/10.1107/s0021889811041161 - Structure, resolution and chiroptical analysis of stable lanthanide complexes of a pyridylphenylphosphinate triazacyclononane ligand
Walton, J. W., Di Bari, L., Parker, D., Pescitelli, G., Puschmann, H., & Yufit, D. S. (2011). Structure, resolution and chiroptical analysis of stable lanthanide complexes of a pyridylphenylphosphinate triazacyclononane ligand. Chemical Communications, 47(45), 12289-12291. https://doi.org/10.1039/c1cc14904k - Full matrix refinement with the small molecule toolbox
Bourhis, L., Dolomanov, O., Gildea, R., Howard, J., & Puschmann, H. (2011). Full matrix refinement with the small molecule toolbox. Acta Crystallographica Section A: Foundations and Advances, 67(S), C593-C594. https://doi.org/10.1107/s0108767311084984 - Olex2-A complete package for molecular crystallography
Puschmann, H., Bourhis, L. J., Dolomanov, O. V., Gildea, R. J., & Howard, J. A. (2011). Olex2-A complete package for molecular crystallography. Acta Crystallographica Section A: Foundations and Advances, 67(S), https://doi.org/10.1107/s0108767311084996 - One-Stop Small-Molecule Crystallography: Olex2.
Puschmann, H., Bourhis, L. J., Dolomanov, O. V., Gildea, R. J., & Howard, J. A. (2010). One-Stop Small-Molecule Crystallography: Olex2. Acta Crystallographica Section A: Foundations and Advances, 66(S), https://doi.org/10.1107/s0108767310097606 - Synthesis and structures of (13-hydroxylamino-5,7,7,13-tetramethyl-1,4,8,11-tetraazacyclotetradec-4- ene-kappa(4))nickel(II) tetrachlorozincate(II) and (13-azonium-5,5,7,13-tetramethyl-1,4,8,11-tetraazacyclotetradecane-kappa (4))nickel(II) tetrachlorozincate(II) chloride 2.25 water
Curtis, N. F., Puschmann, H., & Robinson, W. T. (2009). Synthesis and structures of (13-hydroxylamino-5,7,7,13-tetramethyl-1,4,8,11-tetraazacyclotetradec-4- ene-kappa(4))nickel(II) tetrachlorozincate(II) and (13-azonium-5,5,7,13-tetramethyl-1,4,8,11-tetraazacyclotetradecane-kappa (4))nickel(II) tetrachlorozincate(II) chloride 2.25 water. Polyhedron, 28(14), 2927-2932. https://doi.org/10.1016/j.poly.2009.06.084 - Harnessing the Power of the CCTBX with OLEX2
Gildea, R., Bourhis, L., Dolomanov, O., Howard, J., & Puschmann, H. (2009). Harnessing the Power of the CCTBX with OLEX2. Acta Crystallographica Section A: Foundations and Advances, 65(S), S313-S314. https://doi.org/10.1107/s0108767309093337 - Crystal and Molecular Structures of Some Six-Coordinate Tin(IV) Halogeno Complexes with Phosphorus-Containing Ligands
Batsanov, A. S., Deng, R. M., Dillon, K. B., Goeta, A. E., Howard, J. A., Meldrum, J., Monks, P. K., Puschmann, H., & Shepherd, H. J. (2009). Crystal and Molecular Structures of Some Six-Coordinate Tin(IV) Halogeno Complexes with Phosphorus-Containing Ligands. Heteroatom Chemistry, 20(3), 136-143. https://doi.org/10.1002/hc.20525 - OLEX2 News
Dolomanov, O. V., Bourhis, L. J., Gildea, R. J., Howard, J. A., & Puschmann, H. (2009). OLEX2 News. Acta Crystallographica Section A: Foundations and Advances, 65(S), https://doi.org/10.1107/s0108767309093349 - OLEX2: Workflow and User Experience
Puschmann, H., Bourhis, L., Gildea, R., & Dolomanov, O. (2009). OLEX2: Workflow and User Experience. Acta Crystallographica Section A: Foundations and Advances, 65(S), S315-S316. https://doi.org/10.1107/s0108767309093283 - Small molecule toolbox
Bourhis, L. J., Dolomanov, O., & Puschmann, H. (2008). Small molecule toolbox. Acta Crystallographica Section A: Foundations and Advances, 64(S), https://doi.org/10.1107/s0108767308099479 - Small-molecule refinement using the computational crystallography toolbox (cctbx) with Olex2
Puschmann, H., Bourhis, L., & Dolomanov, O. (2008). Small-molecule refinement using the computational crystallography toolbox (cctbx) with Olex2. Acta Crystallographica Section A: Foundations and Advances, 64(S), https://doi.org/10.1107/s010876730809524x - Workflow and metadata in OLEX2
Gildea, R. J., Bourhis, L., Dolomanov, O. V., Howard, J. A., & Puschmann, H. (2008). Workflow and metadata in OLEX2. Acta Crystallographica Section A: Foundations and Advances, 64(S), C218-C219. https://doi.org/10.1107/s0108767308092982 - Ambiphilic diphosphine-borane ligands: Metal -> borane interactions within isoelectronic complexes of rhodium, platinum and palladium
Bontemps, S., Sircoglou, M., Bouhadir, G., Puschmann, H., Howard, J. A., Dyer, P. W., Miqueu, K., & Bourissou, D. (2008). Ambiphilic diphosphine-borane ligands: Metal -> borane interactions within isoelectronic complexes of rhodium, platinum and palladium. Chemistry - A European Journal, 14(2), 731-740. https://doi.org/10.1002/chem.200701027 - OLEX2: A portable molecular graphics toolset for crystallography
Dolomanov, O. V., Bourhis, L., Puschmann, H., Guildea, R., & Howard, J. A. (2008). OLEX2: A portable molecular graphics toolset for crystallography. Acta Crystallographica Section A: Foundations and Advances, 64(S), https://doi.org/10.1107/s0108767308092970 - Short N center dot center dot center dot O hydrogen bonds in the 1 : 1 adduct of 4,4 `-bipyridyl and oxalic acid
Cowan, J. A., Howard, J. A., Puschmann, H., & Williams, I. D. (2007). Short N center dot center dot center dot O hydrogen bonds in the 1 : 1 adduct of 4,4 `-bipyridyl and oxalic acid. Acta Crystallographica Section E: Crystallographic Communications, 63(3), o1240-o1242. https://doi.org/10.1107/s1600536807005156 - Olex2: Making Small-Molecule Crystallography Accessible To Everyone.
Puschmann, H., & Dolomanov, O. (2007). Olex2: Making Small-Molecule Crystallography Accessible To Everyone. Acta Crystallographica Section A: Foundations and Advances, 63(S), https://doi.org/10.1107/s0108767307097863 - Olex2: a quick prototyping framework for crystallographers
Dolomanov, O., & Puschmann, H. (2007). Olex2: a quick prototyping framework for crystallographers. Acta Crystallographica Section A: Foundations and Advances, 63(S), S74-S75. https://doi.org/10.1107/s0108767307098388 - Luminescent Complexes of Iridium(III) Containing N∧C∧N-Coordinating Terdentate Ligands
Wilkinson, A. J., Puschman, H., Howard, J. A. K., Foster, C. E., & Williams, J. A. G. (2006). Luminescent Complexes of Iridium(III) Containing N∧C∧N-Coordinating Terdentate Ligands. Inorganic Chemistry, 45(21), 8685-8699. https://doi.org/10.1021/ic061172l - Azaxanthones and azathioxanthones are effective sensitisers for europium and terbium luminescence (vol 4, pg 1707, 2006)
Atkinson, P., Findlay, K. S., Kielar, F., Pal, R., Parker, D., Poole, R. A., Puschmann, H., Richardson, S. L., Stenson, P. A., Thompson, A. L., & Yu, J. (2006). Azaxanthones and azathioxanthones are effective sensitisers for europium and terbium luminescence (vol 4, pg 1707, 2006) - Small molecule crystallography for the future
Bourhis, L., Watkin, D., Howard, J., Puschmann, H., & Sadki, M. (2006). Small molecule crystallography for the future. Acta Crystallographica Section A: Foundations and Advances, 62(S), https://doi.org/10.1107/s0108767306095080 - On the role of the counter-ion in defining water structure and dynamics: order, sructure and dynamics in hydrophilic and hydrophobic gadolinium salt complexes
Thompson, A., Parker, D., Fulton, D., Howard, J., Pandya, S., Puschmann, H., Senanayake, K., Stenson, P., Badari, A., Botta, M., Avedano, S., & Aime, S. (2006). On the role of the counter-ion in defining water structure and dynamics: order, sructure and dynamics in hydrophilic and hydrophobic gadolinium salt complexes. Dalton Transactions, 2006(47), 5605-5616. https://doi.org/10.1039/b606206g - Automated Structure Determination
Puschmann, H., & Bourhis, L. (2006). Automated Structure Determination. Acta Crystallographica Section A: Foundations and Advances, 62(S), https://doi.org/10.1107/s0108767306098242 - Olex(2): A Comprehensive Molecular Graphics Tool for Small-Molecule Structures
Puschmann, H., & Dolomanov, O. (2006). Olex(2): A Comprehensive Molecular Graphics Tool for Small-Molecule Structures. Acta Crystallographica Section A: Foundations and Advances, 62(S), https://doi.org/10.1107/s0108767306095092 - Open Source Software for small molecule Crystallography
Sadki, M., Watkin, D., Bourhis, L., Puschmann, H., & Howard, J. (2006). Open Source Software for small molecule Crystallography. Acta Crystallographica Section A: Foundations and Advances, 62(S), https://doi.org/10.1107/s0108767306095018 - Structure of 2-[4-(Dimethylamino)phenyl]-4,5-diphenyl-1H-imidazole Isopropanol Solvate
Au-Alvarez, O., Puschmann, H., Howard, J. A., Martinez, H., & Acevedo, J. (2005). Structure of 2-[4-(Dimethylamino)phenyl]-4,5-diphenyl-1H-imidazole Isopropanol Solvate. Acta Crystallographica Section A: Foundations and Advances, 61(S), https://doi.org/10.1107/s0108767305087489 - Automatic Element Assignment and Model Completion for Small-Molecule Structures
Puschmann, H., & Bourhis, L. (2005). Automatic Element Assignment and Model Completion for Small-Molecule Structures. Acta Crystallographica Section A: Foundations and Advances, 61(S), https://doi.org/10.1107/s0108767305093037