Tomasz Pańczyk

T. Panczyk, K. Nieszporek, P. Wolski, Modeling the degradation of polypropylene and polystyrene under shock compression and mechanical cleaving using the ReaxFF force field, Chemosphere 357 (2024-04-22) 142056.

T. Panczyk, K. Nieszporek, P. Wolski, Surface chemistry of degraded polyethylene terephthalate (PET): Insights from reactive molecular dynamics study, Applied Surface Science 654 (2024-01-30) 159493.

T. Panczyk, K. Nieszporek, Formation of degraded LDPE surfaces using mechanical cleavage and shock compression analyzed by means of molecular dynamics simulations, Computational Materials Science 230 (2023-09-22) 112522.

P. Wolski, T. Panczyk, A. Brzyska, Molecular Dynamics Simulations of Carbon Quantum Dots/Polyamidoamine Dendrimer Nanocomposites, The Journal of Chemical Chemistry C 127 (2023-08-14) 16740-16750.

T. Panczyk, W. Plazinski, F. Dupradeau, A. Brzyska, P. Wolski, Interaction of Chondroitin and Hyaluronan Glycosaminoglycans with Surfaces of Carboxylated Carbon Nanotubes Studied Using Molecular Dynamics Simulations, Molecules 28 (2023-01-13) 826.

M. Szota, P. Wolski, C. Carucci, F. Cesare Marincola, J. Gurgul, T. Pańczyk, A. Salis, B. Jachimska, Effect of Ionization Degree of Poly(amidoamine) Dendrimer and 5-Fluorouracil on the Efficiency of Complex Formation—A Theoretical and Experimental Approach, International Journal of Molecular Sciences 24 (2023-01-03) 819.

T. Pańczyk, J. Nieszporek, K. Nieszporek, Molecular Dynamics Simulations of Interactions between Human Telomeric i-Motif Deoxyribonucleic Acid and Functionalized Graphene, Journal of Physical Chemistry B 126 (2022-08-29) 6671-6681.

T. Panczyk, K. Nieszporek, P. Wolski, Stability and Existence of Noncanonical I-motif DNA Structures in Computer Simulations Based on Atomistic and Coarse-Grained Force Fields, Molecules MDPI 27 (2022-08-01) 4915.

P. Wolski, K. Nieszporek, T. Panczyk, Regulation of water access, storage, separation and release of drugs from the carbon nanotube functionalized by cytosine rich DNA fragments, Biomaterials Advances 137 (2022-05-02) 212835.

C.K. Lee, S. Zhang, G. Venkatesan, N. Irsan, S.Y. Chong, J.-W. Wang, W.J. Goh, T. Panczyk, Y.Z. Tay, J. Hu, W.K. Ng, M.G. Wacker, W.S. Toh, G. Pastorin, Enhanced skin penetration of berberine from proniosome gel attenuates pain and inflammation in a mouse model of osteoarthritis, Biomaterials Science 10 (2022-02-17) 1752-1764.

T. Panczyk, W. Plazinski, A. Brzyska, P. Wolski, Adsorption of hyaluronan saccharides on the surface of a single walled carbon nanotube. A computational study, Applied Surface Science ELSEVIER 584 (2022-01-25) 152599.

T. Pańczyk, P. Wolski, P. Wojton, Molecular dynamics study of the interaction of carbon nanotubes with telomeric DNA fragment containing noncanonical G-quadruplex and I-motif forms, International Journal of Molecular Sciences 21 (2020-01-01) 1925.

P. Wolski, K. Nieszporek, T. Pańczyk, Carbon nanotubes and short cytosine-rich telomeric DNA oligomeres as platforms for controlled release of doxorubicin—a molecular dynamics study, International Journal of Molecular Sciences 21 (2020-01-01) 3619.

A. Jagusiak, K. Chlopas, G. Zemanek, P. Wolski, T. Pańczyk, Controlled release of doxorubicin from the drug delivery formulation composed of single-walled carbon nanotubes and congo red: A molecular dynamics study and dynamic light scattering analysis, Pharmaceutics 12 (2020-01-01) 1-21.

P. Wolski, P. Wojton, K. Nieszporek, T. Pańczyk, Interaction of Human Telomeric i-Motif DNA with Single-Walled Carbon Nanotubes: Insights from Molecular Dynamics Simulations, Journal of Physical Chemistry B 123 (2019-01-01) 10343-10353.

P. Wolski, T. Pańczyk, Conformational Properties of PAMAM Dendrimers Adsorbed on the Gold Surface Studied by Molecular Dynamics Simulation, Journal of Physical Chemistry C 123 (2019-01-01) 22603-22613.

T. Pańczyk, P. Wojton, P. Wolski, Mechanism of unfolding and relative stabilities of G-quadruplex and I-motif noncanonical DNA structures analyzed in biased molecular dynamics simulations, Biophysical Chemistry 250 (2019-01-01) 106173.

A. Jagusiak, K. Chłopaś, G. Zemanek, M. Jemioła-Rzemińska, B. Piekarska, B. Stopa, T. Pańczyk, Self-assembled supramolecular ribbon-like structures complexed to single walled carbon nanotubes as possible anticancer drug delivery systems, International Journal of Molecular Sciences 20 (2019-01-01) 2064.

A. Jagusiak, T. Pańczyk, Interaction of Congo Red, Evans Blue and Titan Yellow with doxorubicin in aqueous solutions. A molecular dynamics study, Journal of Molecular Liquids 279 (2019-01-01) 640-648.

P. Wolski, K. Nieszporek, T. Pańczyk, G-Quadruplex and I-Motif Structures within the Telomeric DNA Duplex. A Molecular Dynamics Analysis of Protonation States as Factors Affecting Their Stability, Journal of Physical Chemistry B 123 (2019-01-01) 468-479.

T. Pańczyk, L. Konczak, P. Wolski, Colloid Nanoparticles and Carbon Nanotubes. What Can We Learn About Their Biomedical Application From Molecular Dynamics Simulations?, Mod. Probl. Mol. Phys. Springer International PublishingCham (2018-01-01) 23–37.

P. Wolski, K. Nieszporek, T. Pańczyk, Multimodal, pH Sensitive, and Magnetically Assisted Carrier of Doxorubicin Designed and Analyzed by Means of Computer Simulations, Langmuir 34 (2018-01-01) 2543–2550.

T. Pańczyk, P. Wolski, Molecular dynamics analysis of stabilities of the telomeric Watson-Crick duplex and the associated i-motif as a function of pH and temperature, Biophys. Chem. 237 (2018-01-01) 22–30.

K. Nieszporek, T. Pańczyk, J. Nieszporek, The inhibition effect of water on the purification of natural gas with nanoporous graphene membranes, Beilstein J. Nanotechnol 9 (2018-01-01) 1906–1916.

J. Goclon, T. Pańczyk, K. Winkler, Investigation of the interfacial properties of polyurethane/carbon nanotube hybrid composites: A molecular dynamics study, Appl. Surf. Sci. 433 (2018-01-01) 213–221.

P. Wolski, T. Pańczyk, Teoretyczne badanie adsorpcji doxorubicyny i wybranych cząsteczek barwników na powierzchni jednościennych nanorurek węglowych, Nowe trendy w fizykochemicznych badaniach granic faz Polskie Towarzystwo ChemiczneLublin (2018-01-01) 123-140.

A. Jagusiak, B. Piekarska, T. Pańczyk, M. Jemiola-Rzeminska, E. Bielanska, B. Stopa, G. Zemanek, J. Rybarska, I. Roterman, L. Konieczny, Dispersion of single-wall carbon nanotubes with supramolecular congo red-properties of the complexes and mechanism of the interaction, Beilstein Journal of Nanotechnology 8 (2017-01-01) 636-648.

P. Wolski, K. Nieszporek, T. Pańczyk, Pegylated and folic acid functionalized carbon nanotubes as pH controlled carriers of doxorubicin. Molecular dynamics analysis of the stability and drug release mechanism, Physical Chemistry Chemical Physics 19 (2017-01-01) 9300-9312.

P. Wolski, J. Narkiewicz-Michalek, M. Panczyk, G. Pastorin, T. Pańczyk, Molecular Dynamics Modeling of the Encapsulation and De-encapsulation of the Carmustine Anticancer Drug in the Inner Volume of a Carbon Nanotube, Journal of Physical Chemistry C 121 (2017-01-01) 18922-18934.

T. Pańczyk, L. Konczak, J. Narkiewicz-Michalek, G. Pastorin, Corking and Uncorking Carbon Nanotubes by Metal Nanoparticles Bearing pH-Cleavable Hydrazone Linkers. Theoretical Analysis Based on Molecular Dynamics Simulations, Journal of Physical Chemistry C 120 (2016-01-01) 639-649.

T. Pańczyk, P. Wolski, L. Lajtar, Coadsorption of Doxorubicin and Selected Dyes on Carbon Nanotubes. Theoretical Investigation of Potential Application as a pH-Controlled Drug Delivery System, Langmuir 32 (2016-01-01) 4719-4728.

A. Jagusiak, B. Piekarska, K. Chłopaś, E. Bielanska, T. Pańczyk, Shortening and dispersion of single-walled carbon nanotubes upon interaction with mixed supramolecular compounds, Bio-Algorithms and Med-Systems 12 (2016-01-01) 123-132.

L. Konczak, J. Narkiewicz-Michalek, G. Pastorin, T. Pańczyk, Effects of intermolecular interactions on the stability of carbon nanotube–gold nanoparticle conjugates in solution, International Journal of Nanomedicine 11 (2016-01-01) 5837-5849.

J. Li, S.L. Yoong, W.J. Goh, B. Czarny, Z. Yang, K. Poddar, M.M. Dykas, A. Patra, T. Venkatesan, T. Pańczyk, C. Lee, G. Pastorin, In vitro controlled release of cisplatin from gold-carbon nanobottles via cleavable linkages, International Journal of Nanomedicine 10 (2015-01-01) 7425-7441.

T. Pańczyk, P. Wolski, L. Konczak, J. Narkiewicz-Michalek, Sidewall functionalization of carbon nanotubes as a method of controlling structural transformations of the magnetically triggered nanocontainer: A molecular dynamics study, Journal of Physical Chemistry C 119 (2015-01-01) 8373-8381.

T. Pańczyk, L. Konczak, S. Zapotoczny, P. Szabelski, M. Nowakowska, Molecular dynamics simulations of proton transverse relaxation times in suspensions of magnetic nanoparticles, Journal of Colloid and Interface Science 437 (2015-01-01) 187-196.

T. Pańczyk, T. Da Ros, G. Pastorin, A. Jagusiak, J. Narkiewicz-Michalek, Role of intermolecular interactions in assemblies of nanocontainers composed of carbon nanotubes and magnetic nanoparticles: A molecular dynamics study, Journal of Physical Chemistry C 118 (2014-01-01) 1353-1363.

J. Li, A. Pant, C.F. Chin, W.H. Ang, C. Ménard-Moyon, T.R. Nayak, D. Gibson, S. Ramaprabhu, T. Pańczyk, A. Bianco, G. Pastorin, In vivo biodistribution of platinum-based drugs encapsulated into multi-walled carbon nanotubes, Nanomedicine: Nanotechnology, Biology, and Medicine 10 (2014-01-01) 1465-1475.

T. Pańczyk, P. Wolski, A. Jagusiak, M. Drach, Molecular dynamics study of Congo red interaction with carbon nanotubes, RSC Advances 4 (2014-01-01) 47304-47312.

T. Pańczyk, W. Rudzinski, Effects of surface heterogeneity of carbon nanotubes in adsorption of colloid nanoparticles studied by means of computer simulations, Adsorption 19 (2013-01-01) 611-618.

T. Pańczyk, A. Jagusiak, G. Pastorin, W. H. Ang, J. Narkiewicz- Michalek, Molecular dynamics study of cisplatin release from carbon nanotubes capped by magnetic nanoparticles, Journal of Physical Chemistry C 117 (2013-01-01) 17327-17336.

B. S. Wong, S. L. Yoong, A. Jagusiak, T. Pańczyk, H. K. Ho, W. H. Ang, G. Pastorin, Carbon nanotubes for delivery of small molecule drugs, Advanced Drug Delivery Reviews 65 (2013-01-01) 1964-2015.

P. Szabelski, W. Rzysko, T. Pańczyk, E. Ghijsens, K. Tahara, Y. Tobe, S. De Feyter, Self-assembly of molecular tripods in two dimensions: Structure and thermodynamics from computer simulations, RSC Advances 3 (2013-01-01) 25159-25165.

T. Pańczyk, W. Rudzinski, A. Jagusiak, Adsorption of colloid nanoparticles on carbon nanotubes studied by means of molecular dynamics simulations, Colloids and Surfaces A: Physicochemical and Engineering Aspects 409 (2012-01-01) 149-158.

J. Li, S.Q. Yap, S.L. Yoong, T.R. Nayak, G. W. Chandra, W.H. Ang, T. Pańczyk, S. Ramaprabhu, S.K. Vashist, F.-S. Sheu, A. Tan, G. Pastorin, Carbon nanotube bottles for incorporation, release and enhanced cytotoxic effect of cisplatin, Carbon 50 (2012-01-01) 1625-1634.

T. Pańczyk, P. Szabelski, M. Drach, Implicit solvent model for effective molecular dynamics simulations of systems composed of colloid nanoparticles and carbon nanotubes, Journal of Colloid and Interface Science 383 (2012-01-01) 55-62.

T. Pańczyk, M. Drach, P. Szabelski, A. Jagusiak, Magnetic Anisotropy Effects on the Behavior of a Carbon Nanotube Functionalized by Magnetic Nanoparticles Under External Magnetic Fields, Journal of Physical Chemistry C 116 (2012-01-01) 26091-26101.

T. Pańczyk, T. P. Warzocha, P. J. Camp, Enhancing the control of a magnetically capped molecular nanocontainer: Monte Carlo studies, Journal of Physical Chemistry C 115 (2011-01-01) 7928-7938.

T. Pańczyk, P.J. Camp, G. Pastorin, T.P. Warzocha, Computational Study of Some Aspects of Chemical Optimization of a Functional Magnetically Triggered Nanocontainer, Journal of Physical Chemistry C 115 (2011-01-01) 19074-19083.

P. Szabelski, T. P. Warzocha, T. Pańczyk, Thermal desorption of chiral molecules from a nanostructured chiral surface: Insights from computer simulations, Thermochimica Acta 497 (2010-01-01) 77-84.

T. Pańczyk, V. Fiorin, T. P. Warzocha, Influence of the rotational degrees of freedom on the initial sticking probability of water on Pt {110 }-(1×2): A molecular dynamics study, Journal of Chemical Physics 133 (2010-01-01) 034708.

T. Pańczyk, T. P. Warzocha, P. J. Camp, A Magnetically Controlled Molecular Nanocontainer as a Drug Delivery System: The Effects of Carbon Nanotube and Magnetic Nanoparticle Parameters from Monte Carlo Simulations, Journal of Physical Chemistry C 114 (2010-01-01) 21299–21308.

T. P. Warzocha, T. Pańczyk, P.J. Camp, Nanocapsule composed of carbon nanotube and magnetic nanoparticles. Monte Carlo studies of its potential use as a drug delivery system, Science and Supercomputing in Europe HPC-Europa2http://www.hpc-europa.eu/?q=node/119 58 (2010-01-01) 58.

T. Pańczyk, V. Fiorin, R. Blanco-Alemany, D.A. King, Dynamics of Water Adsorption on Pt {110} - (1×2): a Molecular Dynamics Study, J. Chem. Phys. 131 (2009-01-01) 064703.

T. Pańczyk, T.P. Warzocha, Monte Carlo Study of the Properties of a Carbon Nanotube Functionalized by Magnetic Nanoparticles, J. Phys. Chem. C 113 (2009-01-01) 19155-19160.

T. Pańczyk, T.P. Warzocha, P. Szabelski, W. Rudzinski, Kinetic Adsorption Energy Distributions of Rough Surfaces: a Computational Study, Langmuir 24 (2008-01-01) 8719-8725.

P. Szabelski, T. Pańczyk, M. Drach, Monte Carlo Modeling of Chiral Adsorption on Nanostructured Chiral Surfaces and Slit Pores, Langmuir 24 (2008-01-01) 12972-12980.

T. Pańczyk, T.P. Warzocha, W. Rudzinski, Studies of the Collision Frequency of Ideal Gas Particles with the Surfaces of the Objects Created Using the Ballistic Deposition Technique, Appl. Surf. Sci. 254 (2008-01-01) 2285-2291.

T. Pańczyk, Collisions of Ideal Gas Molecules with a Rough/fractal Surface. A Computational Study, J. Phys. Chem. C 111 (2007-01-01) 3175-3184.

P. Szabelski, T. Pańczyk, Computer Modeling of Dissociative Gas Adsorption on Laser-roughened Surfaces, Appl. Surf. Sci. 253 (2007-01-01) 5622-5627.

T. Pańczyk, T. Warzocha, W. Rudzinski, Molecular Dynamics Study of the Equilibrium Flux of Gas Molecules to a Fractal/rough Surface. Effects of Gas Atom Diameter, Appl. Surf. Sci. 253 (2007-01-01) 5846-5850.

T. Pańczyk, W. Gac, M. Panczyk, T. Borowiecki, W. Rudzinski, On the Equilibrium Nature of Thermodesorption Processes. TPD-NH3 Studies f Surface Acidity f Ni/MgO-Al2O3 Catalysts, Langmuir 22 (2006-01-01) 6613-6621.

T. Pańczyk, Sticking Coefficient and Pressure Dependence of Desorption rate in the Statistical Rate Theory Approach to the Kinetics of Gas Adsorption. Carbon Monoxide Adsorption/Desorption Rates on the Polycrystalline Rhodium Surface, Phys. Chem. Chem. Phys. 8 (2006-01-01) 3782-3795.

T. Pańczyk, P. Szabelski, W. Rudzinski, Hydrogen Adsorption on Nickel (100) Single Crystal Face. A Monte Carlo Study of The Equilibrium and Kinetics, J. Phys. Chem. B 109 (2005-01-01) 10986-10994.

W. Rudzinski, T. Pańczyk, W. Płaziński, Kinetics of Isothermal Gas Adsorption on Heterogeneous Solid Surfaces: Equations Based on Generalization of the Statistical Rate Theory of Interfacial Transport, J. Phys. Chem. B 109 (2005-01-01) 21868-21878.

T. Pańczyk, F. Villieras, Monte Carlo Simulations of Controlled Rate Thermal Analysis Spectra - The Influence of Surface Energetic Heterogeneity and Lateral Interactions between Adsorbed Molecules, Appl. Surf. Sci. 239 (2005-01-01) 353-366.

T. Pańczyk, W. Rudzinski, On the Ways of Generalization of Adsorption Kinetic Equations for the Case of Energetically Heterogeneous Surfaces, Appl. Surf. Sci. 252 (2005-01-01) 678-686.

T. Pańczyk, The Influence of a Small Amount of Active Sites on the Adsorption Kinetics of Nitrogen on Ruthenium, Appl Surf. Sci. 252 (2005-01-01) 687-698.

P. Szabelski, T. Pańczyk, W. Rudzinski, Theoretical Study of the Influence of Laser-induced Defects on the Adsorption of Gases on Solid Surfaces, Appl. Surf. Sci. 252 (2005-01-01) 582-590.

T. Pańczyk, W. Gac, M. Panczyk, A. Dominko, T. Borowiecki, W. Rudzinski, Thermodesorption Studies of Energetic Properties of Ni/MgO-Al2O3 Catalysts. Determination of Adsorption Energy Distribution Functions, Langmuir 21 (2005-01-01) 7311-7320.

T. Pańczyk, F. Villieras, W. Rudzinski, M. Pelletier, A. Razafitianatiaharavo, A Quantitative Study of Solid Surface Heterogeneity Based on the Statistical Rate Theory to Analyze Spectra of Controlled-Rate Thermal Analysis, Phys. Chem. Chem. Phys. 6 (2004-01-01) 3684-3693.

T. Pańczyk, W. Rudzinski, A Statistical Rate Theory Approach to Kinetics of Dissociative Gas Adsorption on Solids, J. Phys. Chem. B 108 (2004-01-01) 2898-2909.

T. Pańczyk, Application of the Statistical Rate Theory to the Computer Simulations of Adsorption Kinetics, Appl. Surf. Sci. 222 (2004-01-01) 307-321.

T. Pańczyk, W. Rudzinski, Kinetics of Dissociative Hydrogen Adsorption on the (100) Nickel Single Crystal Face: A Statistical Rate Theory Approach, Appl. Surf. Sci. 233 (2004-01-01) 141-154.

T. Pańczyk, W. Rudzinski, Kinetics of gas adsorption on strongly heterogeneous solid surfaces: A Statistical Rate Theory Approach, Korean J. Chem. Eng. 21 (2004-01-01) 206-211.

T. Pańczyk, W. Rudzinski, Monte Carlo Modeling of Adsorption Equilibrium and Kinetics in the System H2/Ni(100), Ann. Polish Chem. Soc. 3 (2004-01-01) 571-574.

T. Pańczyk, W. Rudzinski, A Simultaneous Description of Kinetics and Equilibria of Adsorption on Heterogenous Solid Surfaces Based on the Statistical Rate Theory of Interfacial Transport, Langmuir 19 (2003-01-01) 1173-1181.

T. Pańczyk, P. Szabelski, The Influence of Lateral Interactions between Adsorbed Molecules on Adsorption Kinetics. A Statistical Rate Theory Approach, J. Phys. Chem. B 107 (2003-01-01) 5586-5597.

T. Pańczyk, W. Rudzinski, Kinetics of Multi-Site-Occupancy Adsorption on Heterogeneous Solid Surfaces: A Statistical Rate Theory Approach, J. Phys. Chem. B 106 (2002-01-01) 7846-7851.

W. Rudzinski, T. Pańczyk, Remarks on the Current State of Adsorption Kinetic Theories for Heterogeneous Solid Surfaces: a Comparison of the ART and the SRT Approaches, Langmuir 18 (2002-01-01) 439-449.

W. Rudzinski, T. Pańczyk, The Langmuirian Adsorption Kinetics Revised: a Farewell to the XX-th Century Theories?, Adsorption 8 (2002-01-01) 23-24.

T. Pańczyk, W. Rudzinski, T. Borowiecki, A. Dominko, The Procedure for Evaluating the Adsorption Energy Distribution from the Analysis of Thermodesorption Spectra Based on the Statistical Rate Theory, Adsorption Sci. Technol. 20 (2002-01-01) 381-391.

P. Szabelski, T. Pańczyk, W. Rudzinski, Thermal Desorption from Surfaces with Laser-Induced Deffects, Appl. Surf. Sci. 202 (2002-01-01) 232-240.