Michele Cascella
Professor
-
Teoretisk kjemi
English version of this page
Rom
V 224
Brukernavn
Besøksadresse
Sem Sælands vei 26
0371 Oslo
Postadresse
Postboks 1033
0315 Oslo
Publikasjoner
-
Carrer, Manuel; Nielsen, Josefine Eilsø; Musseli Cezar, Henrique; Lund, Reidar; Cascella, Michele & Soares da Silva, Thereza Amelia (2023). Accelerating Lipid Flip-Flop at Low Concentrations: A General Mechanism for Membrane Binding Peptides. The Journal of Physical Chemistry Letters. ISSN 1948-7185. 14(31), s. 7014–7019. doi: 10.1021/acs.jpclett.3c01284. Fulltekst i vitenarkiv
-
Musseli Cezar, Henrique & Cascella, Michele (2023). SANS Spectra with PLUMED: Implementation and Application to Metainference. Journal of Chemical Information and Modeling. ISSN 1549-9596. 63(16), s. 4979–4985. doi: 10.1021/acs.jcim.3c00724. Fulltekst i vitenarkiv
-
de Giovanetti, Marinella; Eliasson, Sondre Hilmar Hopen; Castro, Abril C; Eisenstein, Odile & Cascella, Michele (2023). Morphological Plasticity of LiCl Clusters Interacting with Grignard Reagent in Tetrahydrofuran. Journal of the American Chemical Society. ISSN 0002-7863. 145(30), s. 16305–16309. doi: 10.1021/jacs.3c04238. Fulltekst i vitenarkiv
-
Segura Pena, Dario; Hovet, Oda; Gogoi, Hemanga; Dawicki-Mckenna, Jennine; Wøien, Stine Malene Hansen & Carrer, Manuel [Vis alle 9 forfattere av denne artikkelen] (2023). The structural basis of the multi-step allosteric activation of Aurora B kinase. eLIFE. ISSN 2050-084X. 12. doi: 10.7554/eLife.85328. Fulltekst i vitenarkiv Vis sammendrag
-
Bjørnestad, Victoria Ariel; Li, Xinmeng; Tribet, Christophe; Lund, Reidar & Cascella, Michele (2023). Micelle kinetics of photoswitchable surfactants: Self-assembly pathways and relaxation mechanisms. Journal of Colloid and Interface Science. ISSN 0021-9797. 646, s. 883–899. doi: 10.1016/j.jcis.2023.05.057. Fulltekst i vitenarkiv
-
Ledum, Morten; Sen, Samiran; Li, Xinmeng; Carrer, Manuel; Feng, Yu & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2023). HylleraasMD: A Domain Decomposition-Based Hybrid Particle-Field Software for Multiscale Simulations of Soft Matter. Journal of Chemical Theory and Computation. ISSN 1549-9618. doi: 10.1021/acs.jctc.3c00134. Fulltekst i vitenarkiv
-
Ledum, Morten; Sen, Samiran; Bore, Sigbjørn Løland & Cascella, Michele (2023). On the equivalence of the hybrid particle-field and Gaussian core models. Journal of Chemical Physics. ISSN 0021-9606. 158(19). doi: 10.1063/5.0145142. Fulltekst i vitenarkiv
-
Ledum, Morten; Carrer, Manuel; Sen, Samiran; Li, Xinmeng; Cascella, Michele & Bore, Sigbjørn Løland (2023). HylleraasMD: Massively parallel hybrid particle-field molecular dynamics in Python. Journal of Open Source Software (JOSS). ISSN 2475-9066. 8(84). doi: 10.21105/joss.04149. Fulltekst i vitenarkiv
-
Castro, Abril C; Cascella, Michele; Perutz, Robin N.; Raynaud, Christophe & Eisenstein, Odile (2023). Solid-State 19F NMR Chemical Shift in Square-Planar Nickel-Fluoride Complexes Linked by Halogen Bonds. Inorganic Chemistry. ISSN 0020-1669. 62(12), s. 4835–4846. doi: 10.1021/acs.inorgchem.2c04063. Fulltekst i vitenarkiv
-
Sen, Samiran; Ledum, Morten; Bore, Sigbjørn Løland & Cascella, Michele (2023). Soft Matter under Pressure: Pushing Particle-Field Molecular Dynamics to the Isobaric Ensemble. Journal of Chemical Information and Modeling. ISSN 1549-9596. 63, s. 2207–2217. doi: 10.1021/acs.jcim.3c00186. Fulltekst i vitenarkiv
-
Thorbjørnsrud, Helen Vikdal; Bressan, Lucas; Khatanbaatar, Tamjidmaa; Carrer, Manuel; Würth-Roderer, Kathrin & Cordara, Gabriele [Vis alle 9 forfattere av denne artikkelen] (2023). What Drives Chorismate Mutase to Top Performance? Insights from a Combined In Silico and In Vitro Study. Biochemistry. ISSN 0006-2960. 62(3), s. 782–796. doi: 10.1021/acs.biochem.2c00635. Fulltekst i vitenarkiv
-
Thorbjørnsrud, Helen Vikdal; Bressan, Luca; Khatanbaatar, Tamjidmaa; Carrer, Manuel; Würth-Roderer, Kathrin & Cordara, Gabriele [Vis alle 9 forfattere av denne artikkelen] (2022). What drives chorismate mutase to top performance? Insights from a combined in silico and in vitro study. bioRxiv. ISSN 2692-8205. doi: 10.1101/2022.11.08.515563.
-
Sekulic, Nikolina; Hovet, Oda; Gogoi, Hemanga; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen & Carrer, Manuel [Vis alle 8 forfattere av denne artikkelen] (2022). The structural basis of the multi-step allosteric activation of Aurora B kinase. bioRxiv. ISSN 2692-8205.
-
Cascella, Michele & Soares da Silva, Thereza Amelia (2022). Bias Amplification in Gender, Gender Identity, and Geographical Affiliation. Journal of Geophysical Research (JGR): Solid Earth. ISSN 2169-9313. doi: 10.1021/acs.jcim.2c00533. Fulltekst i vitenarkiv
-
Kirsch, Till; Olsen, Jógvan Magnus Haugaard; Bolnykh, Viacheslav; Meloni, Simone; Ippoliti, Emiliano & Rothlisberger, Ursula [Vis alle 8 forfattere av denne artikkelen] (2021). Wavefunction-Based Electrostatic-Embedding QM/MM Using CFOUR through MiMiC. Journal of Chemical Theory and Computation. ISSN 1549-9618. doi: 10.1021/acs.jctc.1c00878. Fulltekst i vitenarkiv
-
Aeschimann, Walter; Kammer, Stephan; Staats, Stefanie; Schneider, Petra; Schneider, Gisbert & Rimbach, Gerald [Vis alle 8 forfattere av denne artikkelen] (2021). Engineering of a functional γ-tocopherol transfer protein. Redox Biology. ISSN 2213-2317. 38. doi: 10.1016/j.redox.2020.101773. Fulltekst i vitenarkiv
-
Castro, Abril C; Balcells, David; Repisky, Michal; Helgaker, Trygve & Cascella, Michele (2020). First-principles calculation of 1H NMR chemical shifts of complex metal polyhydrides: The essential inclusion of relativity and dynamics. Inorganic Chemistry. ISSN 0020-1669. 59(23), s. 17509–17518. doi: 10.1021/acs.inorgchem.0c02753. Fulltekst i vitenarkiv
-
Franco-Ulloa, Sebastian; Tatulli, Giuseppina; Bore, Sigbjørn Løland; Moglianetti, Mauro; Pompa, Pier Paolo & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2020). Dispersion state phase diagram of citrate-coated metallic nanoparticles in saline solutions. Nature Communications. ISSN 2041-1723. 11. doi: 10.1038/s41467-020-19164-3. Fulltekst i vitenarkiv
-
Schäfer, Ken; Kolli, Hima Bindu; Christensen, Mikkel Killingmoe; Bore, Sigbjørn Løland; Diezemann, Gregor & Gauss, Jürgen [Vis alle 9 forfattere av denne artikkelen] (2020). Supramolecular Packing Drives Morphological Transitions of Charged Surfactant Micelles. Angewandte Chemie International Edition. ISSN 1433-7851. 59(42), s. 18591–18598. doi: 10.1002/anie.202004522. Fulltekst i vitenarkiv
-
Carrer, Manuel; Skrbic, Tatjana; Bore, Sigbjørn Løland; Milano, Giuseppe; Cascella, Michele & Giacometti, Achille (2020). Can Polarity-Inverted Surfactants Self-Assemble in Nonpolar Solvents? Journal of Physical Chemistry B. ISSN 1520-6106. 124, s. 6448–6458. doi: 10.1021/acs.jpcb.0c04842. Fulltekst i vitenarkiv
-
Bore, Sigbjørn Løland & Cascella, Michele (2020). Hamiltonian and alias-free hybrid particle-field molecular dynamics. Journal of Chemical Physics. ISSN 0021-9606. 153(9). doi: 10.1063/5.0020733. Fulltekst i vitenarkiv
-
Ledum, Morten; Bore, Sigbjørn Løland & Cascella, Michele (2020). Automated determination of hybrid particle-field parameters by machine learning. Molecular Physics. ISSN 0026-8976. 118(19-20), s. 1–12. doi: 10.1080/00268976.2020.1785571. Fulltekst i vitenarkiv
-
Peltzer, Raphael Mathias; Gauss, Jürgen; Eisenstein, Odile & Cascella, Michele (2020). The Grignard Reaction − Unraveling a Chemical Puzzle. Journal of the American Chemical Society. ISSN 0002-7863. 142(6), s. 2984–2994. doi: 10.1021/jacs.9b11829. Fulltekst i vitenarkiv
-
De Nicola, Antonio; Soares, Thereza; Santos, Denys ES; Bore, Sigbjørn Løland; Sevink, G J Agur & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2020). Aggregation of Lipid A Variants: A Hybrid Particle-Field Model. Biochimica et Biophysica Acta - General Subjects. ISSN 0304-4165. 1865. doi: 10.1016/j.bbagen.2020.129570. Fulltekst i vitenarkiv
-
Bore, Sigbjørn Løland; Kolli, Hima Bindu; De Nicola, Antonio; Byshkin, Maksym; Kawakatsu, Toshihiro & Milano, Giuseppe [Vis alle 7 forfattere av denne artikkelen] (2020). Hybrid Particle-Field Molecular Dynamics Under Constant Pressure. Journal of Chemical Physics. ISSN 0021-9606. 152(18). doi: 10.1063/5.0007445. Fulltekst i vitenarkiv
-
Castro, Abril C.; Fliegl, Heike; Cascella, Michele; Helgaker, Trygve; Repisky, Michal & Komorovsky, Stanislav [Vis alle 9 forfattere av denne artikkelen] (2019). Four-component relativistic 31P NMR calculations for: Trans -platinum(ii) complexes: Importance of the solvent and dynamics in spectral simulations. Dalton Transactions. ISSN 1477-9226. 48(23), s. 8076–8083. doi: 10.1039/c9dt00570f. Fulltekst i vitenarkiv
-
Bore, Sigbjørn Løland; Kolli, Hima Bindu; Kawakatsu, Toshihiro; Milano, Giuseppe & Cascella, Michele (2019). Mesoscale Electrostatics Driving Particle Dynamics in Nonhomogeneous Dielectrics. Journal of Chemical Theory and Computation. ISSN 1549-9618. 15(3), s. 2033–2041. doi: 10.1021/acs.jctc.8b01201.
-
Kolli, Hima Bindu; De Nicola, Antonio; Bore, Sigbjørn Løland; Schäfer, Ken; Diezemann, Gregor & Gauss, Jürgen [Vis alle 11 forfattere av denne artikkelen] (2018). Hybrid particle-field molecular dynamics simulations of charged amphiphiles in an aqueous environment. Journal of Chemical Theory and Computation. ISSN 1549-9618. 14(9), s. 4928–4937. doi: 10.1021/acs.jctc.8b00466.
-
Peltzer, Raphael Mathias; Kolli, Hima Bindu; Stocker, Achim & Cascella, Michele (2018). Self-assembly of alpha-tocopherol transfer protein nanoparticles: a patchy-protein model. Journal of Physical Chemistry B. ISSN 1520-6106. 122(28), s. 7066–7072. doi: 10.1021/acs.jpcb.8b05936. Fulltekst i vitenarkiv
-
Correa, Andrea; Cascella, Michele; Scotti, Nicola; Zaccheria, Federica; Ravasio, Nicoletta & Psaro, Rinaldo (2018). Mechanistic insights into formic acid dehydrogenation promoted by Cu-amino based systems. Inorganica Chimica Acta. ISSN 0020-1693. 470, s. 290–294. doi: 10.1016/j.ica.2017.06.043. Fulltekst i vitenarkiv
-
Jaschonek, Stefan; Cascella, Michele; Gauss, Jurgen; Diezemann, Gregor & Milano, Giuseppe (2018). Intramolecular structural parameters are key modulators of the gel-liquid transition in coarse grained simulations of DPPC and DOPC lipid bilayers. Biochemical and Biophysical Research Communications - BBRC. ISSN 0006-291X. 498(2), s. 327–333. doi: 10.1016/j.bbrc.2017.10.132. Fulltekst i vitenarkiv
-
Sommer, Theis; Bjerregaard-Andersen, Kaare; Uribe, Lalita; Etzerodt, Michael; Diezemann, Gregor & Gauss, Jürgen [Vis alle 8 forfattere av denne artikkelen] (2018). A fundamental catalytic difference between zinc and manganese dependent enzymes revealed in a bacterial isatin hydrolase. Scientific Reports. ISSN 2045-2322. 8(13104), s. 1–11. doi: 10.1038/s41598-018-31259-y. Fulltekst i vitenarkiv
-
Bore, Sigbjørn Løland; Milano, Giuseppe & Cascella, Michele (2018). Hybrid Particle-Field Model for Conformational Dynamics of Peptide Chains. Journal of Chemical Theory and Computation. ISSN 1549-9618. 14(2), s. 1120–1130. doi: 10.1021/acs.jctc.7b01160. Fulltekst i vitenarkiv
-
Uribe, Lalita; Diezemann, Gregor; Gauss, Jürgen; Morth, Jens Preben & Cascella, Michele (2018). Structural origin of metal specificity in isatin hydrolase from Labrenzia aggregata investigated by computer simulations. Chemistry - A European Journal. ISSN 0947-6539. 24(20), s. 5074–5077. doi: 10.1002/chem.201705159.
-
Soares, Thereza; Vanni, Stefano; Milano, Giuseppe & Cascella, Michele (2017). Toward Chemically Resolved Computer Simulations of Dynamics and Remodeling of Biological Membranes. The Journal of Physical Chemistry Letters. ISSN 1948-7185. 8, s. 3586–3594. doi: 10.1021/acs.jpclett.7b00493.
-
Aeschimann, Walter; Staats, Stefanie; Kammer, Stephan; Olieric, Natacha; Jeckelmann, Jean-Marc & Fotiadis, Dimitrios [Vis alle 10 forfattere av denne artikkelen] (2017). Self-assembled α-Tocopherol Transfer Protein Nanoparticles Promote Vitamin E Delivery Across an Endothelial Barrier. Scientific Reports. ISSN 2045-2322. 7(1). doi: 10.1038/s41598-017-05148-9.
-
Pizzirusso, Antonio; De Nicola, Antonio; Sevink, G J Agur; Correa, Andrea; Cascella, Michele & Kawakatsu, Toshihiro [Vis alle 10 forfattere av denne artikkelen] (2017). Biomembrane solubilization mechanism by Triton X-100: A computational study of the three stage model. Physical Chemistry, Chemical Physics - PCCP. ISSN 1463-9076. 19(44), s. 29780–29794. doi: 10.1039/c7cp03871b.
-
Peltzer, Raphael Mathias; Eisenstein, Odile; Nova, Ainara & Cascella, Michele (2017). How Solvent Dynamics Controls the Schlenk Equilibrium of Grignard Reagents: A Computational Study of CH3MgCl in Tetrahydrofuran. Journal of Physical Chemistry B. ISSN 1520-6106. 121(16), s. 4226–4237. doi: 10.1021/acs.jpcb.7b02716. Fulltekst i vitenarkiv
-
Cascella, Michele & Vanni, Stefano (2016). Toward accurate coarse-graining approaches for protein and membrane simulations. Chemical Modelling. ISSN 1472-0965. 12, s. 1–52. doi: 10.1039/9781782622703-00001.
-
Cascella, Michele & Vanni, Stefano (2016). Toward accurate coarse-graining approaches for protein and membrane simulations. Spectroscopic Properties of Inorganic and Organometallic Compounds (SPR). ISSN 0584-8555. 12, s. 1–52. doi: 10.1039/9781782622703-00001.
-
Cascella, Michele; Dal Peraro, Matteo & De Vivo, Marco (2015). Computational Chemistry Strategies Tackling Function and Inhibition of Pharmaceutically Relevant Targets. I Ul-Haq, Zaheer & Madura, Jeffry (Red.), Frontiers in Computational Chemistry, Vol. 1. Bentham eBooks. ISSN 978-1-60805-865-5. s. 290–343.
-
Cascella, Michele & Vanni, Stefano (2015). Toward accurate coarse-graining approaches for protein and membrane simulations. I Oswig, Jan-Ole & Springborg, Michael (Red.), Specialist Periodical Reports - Chemical Modelling Vol. 12. Royal Society of Chemistry (RSC). ISSN 978-1-78262-115-7. s. 1–52. doi: 10.1039/9781782622703-00001.
-
Geng, Yan; Yi, Chenyi; Bircher, Martin Peter; Decurtins, Silvio; Cascella, Michele & Grätzel, Michael [Vis alle 7 forfattere av denne artikkelen] (2015). Anthanthrene dye-sensitized solar cells: Influence of the number of anchoring groups and substitution motif. RSC Advances. ISSN 2046-2069. 5(119), s. 98643–98652. doi: 10.1039/c5ra21917e.
-
Christen, Monika; Marcaida, Maria J.; Lamprakis, Christos; Aeschimann, Walter; Vaithilingam, Jathana & Schneider, Petra [Vis alle 10 forfattere av denne artikkelen] (2015). Structural insights on cholesterol endosynthesis: Binding of squalene and 2,3-oxidosqualene to supernatant protein factor. Journal of Structural Biology. ISSN 1047-8477. 190(3), s. 261–270. doi: 10.1016/j.jsb.2015.05.001.
-
Garbuio, Viviana; Cascella, Michele; Kupchak, Igor; Pulci, Olivia & Seitsonen, Ari Paavo (2015). Proton disorder in cubic ice: Effect on the electronic and optical properties. Journal of Chemical Physics. ISSN 0021-9606. 143(8). doi: 10.1063/1.4929468.
-
Lamprakis, Christos; Stocker, Achim & Cascella, Michele (2015). Mechanisms of recognition and binding of α-TTP to the plasma membrane by multi-scale molecular dynamics simulations. Frontiers in Molecular Biosciences. ISSN 2296-889X. 2. doi: 10.3389/fmolb.2015.00036. Fulltekst i vitenarkiv
-
Helbling, Rachel E; Lamprakis, Christos; Aeschimann, Walter; Bolze, Cristin S; Stocker, Achim & Cascella, Michele (2014). Mechanisms of ligand-protein interaction in Sec-14-like transporters investigated by computer simulations. Chimia (Basel). ISSN 0009-4293. 68(9), s. 615–619. doi: 10.2533/chimia.2014.615.
-
Palczewska, Grazyna; Vinberg, Frans; Stremplewski, Patrycjusz; Bircher, Martin P; Salom, David & Komar, Katarzyna [Vis alle 11 forfattere av denne artikkelen] (2014). Human infrared Vision is triggered by two-photon chromophore isomerization. Proceedings of the National Academy of Sciences of the United States of America. ISSN 0027-8424. 111(50), s. E5445–E5454. doi: 10.1073/pnas.1410162111.
-
Amacher, Anneliese; Yi, Chenyi; Yang, Jiabao; Bircher, Martin Peter; Fu, Yongchun & Cascella, Michele [Vis alle 9 forfattere av denne artikkelen] (2014). A quinoxaline-fused tetrathiafulvalene-based sensitizer for efficient dye-sensitized solar cells. Chemical Communications. ISSN 1359-7345. 50(49), s. 6540–6542. doi: 10.1039/c4cc02696a.
-
Eisenstein, Odile; Cascella, Michele & Pradier, Claire-Marie (2021). La reaction de Grignard, une enigme de 120 ans chapter in Etonnante Chimie Decouvertes et promesses du XXIeme siècle. CNRS Editions. ISBN 978-2-271-13652-7. 340 s.
-
Eliasson, Sondre Hilmar Hopen; de Giovanetti, Marinella; Bore, Sigbjørn Løland; Bortoli, Marco; Cascella, Michele & Eisenstein, Odile (2023). Machine Learned Potential for Organolithium in THF.
-
Eliasson, Sondre Hilmar Hopen; de Giovanetti, Marinella; Bore, Sigbjørn Løland; Bortoli, Marco & Cascella, Michele (2023). Machine Learned Potential for Organolithium Compounds in THF. .
-
Cascella, Michele (2023). Multiscale approaches for bio/soft matter: investigating self-assembly and dynamics of lipid and surfactants.
-
Segura-Pena, Dario; Hovet, Oda; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen; Black, Ben E. & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2022). The structural basis of the multi-step allosteric activation of Aurora B kinase.
-
Segura-Pena, Dario; Hovet, Oda; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen; Black, Ben E. & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2022). The structural basis of the multi-step allosteric activation of Aurora B kinase.
-
Segura-Pena, Dario; Hovet, Oda; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen; Black, Ben E. & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2022). HDX and MD as tools to elucidate Aurora B kinase activation mechanism .
-
Segura-Pena, Dario; Hovet, Oda; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen; Black, Ben E. & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2022). The structural basis of the multi-step allosteric activation of Aurora B kinase.
-
Segura-Pena, Dario; Hovet, Oda; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen; Black, Ben E. & Cascella, Michele [Vis alle 7 forfattere av denne artikkelen] (2022). Phosphorylation structurally organizes the [Aurora B/IN-box] complex and introduces a synchronised internal motion of the enzyme resulting in activation .
-
Sekulic, Nikolina; Segura-Pena, Dario; Hovet, Oda; Dawicki-McKenna, Jennine; Wøien, Stine Malene Hansen & Black, Ben E. [Vis alle 7 forfattere av denne artikkelen] (2022). Aurora B activation requires synchronized internal motion initiated by IN-box phosphorylation .
-
Cascella, Michele (2022). The Grignard reaction - solving a century old problem by molecular simulations.
-
Eisenstein, Odile & Cascella, Michele (2021). Grignard reagent and Grignard reaction: Computational approach of a chemical puzzle.
-
Lund, Reidar & Cascella, Michele (2021). Aggregation kinetics and photodynamics of photocontrollable surfactant AzoTMA: a molecular dynamics study.
-
Cascella, Michele (2020). Recent advances in hybrid particle field: toward biological systems.
-
Cascella, Michele (2019). Simulating biological systems coupling particles and fields with molecular dynamics.
-
Cascella, Michele (2019). Simulating biological systems coupling particles and fields with molecular dynamics.
-
Cascella, Michele (2019). Simulating biological systems coupling particles and fields with molecular dynamics .
-
Cascella, Michele (2019). Simulating biological soft systems coupling particles and fields with molecular dynamics.
-
Cascella, Michele (2019). Multiscale simulations of bio/soft-matter using particles and fields.
-
Cascella, Michele (2019). Simulating Biological Systems Coupling Particles and Fields with Molecular Dynamics.
-
Cascella, Michele (2018). Toward Molecular-Resolved Mesoscale Simulations of Soft Matter.
-
Cascella, Michele (2018). Hybrid particle-field molecular dynamics: state of the art and challenges.
-
Cascella, Michele (2018). Hybrid particle field models for peptide chains .
-
Cascella, Michele (2018). Entropy-driven polymorphism in micellar aggregates of a charged surfactant — a multi-scale study.
-
Cascella, Michele (2018). Coarse grained models of protein and peptides using particles and fields .
-
Cascella, Michele (2018). Coarse-graining peptides -- from particles to fields.
-
Cascella, Michele (2018). Coarse-graining peptides -- From particles to fields.
-
Cascella, Michele (2017). Coarse-graining peptides -- From particles to fields.
-
Cascella, Michele (2015). Beyond Millisecond Dynamics of Large Macromolecular Systems Using Coarse-Grained and Hybrid Particle/Field Approaches.
-
Cascella, Michele (2015). A Native Human Protein Nanoconstruct with Acquired Transcytocic Properties through Endothelial Barriers.
-
Cascella, Michele (2015). A Native Human Protein Nanoconstruct with Acquired Transcytocic Properties through Endothelial Barriers.
-
Cascella, Michele (2015). A Native Human Protein Nanoconstruct with Acquired Transcytocic Properties through Endothelial Barriers.
-
Cascella, Michele (2015). Discovery of a Novel Enzymatic Function in Cellular Retinal Binding Protein.
-
Cascella, Michele (2014). Modulation of protein function by micro-solvation effects: the puzzling case of cis-retinal binding in CRALBP.
-
Cascella, Michele (2014). Lipid recognition and exchange mechanisms in transporters of the Sec-14 like family.
-
Cascella, Michele (2014). Lipophilic transporters of the Sec 14-like family: structure, dynamics, and function explored by computer simulations.
-
Cascella, Michele (2014). Multi-scale simulation of proteins: from the Schroedinger equation to coarse grained modelling.
-
Cascella, Michele (2014). Multi-scale simulations of proteins: from the Schroedinger equation to coarse-grained modelling.
-
Carrer, Manuel & Cascella, Michele (2023). From all-atom to mesoscale : bridging the gap with differentiable molecular dynamic. University of Oslo, Faculty of Mathematics and Natural Sciences, Department of Chemistry. ISSN 1501-7710. 2023(2649).
-
Sen, Samiran & Cascella, Michele (2023). Advances in Hamiltonian Hybrid Particle–Field Theory: Improving the description of interfacial systems. University of Oslo, Faculty of Mathematics and Natural Sciences, Department of Chemistry. ISSN 1501-7710. 2023(2618). Vis sammendrag
-
Mors, Mira & Cascella, Michele (2023). Molecular Modeling of Nucleosome Core Particles. Kjemisk Institutt, Universitetet i Oslo. Vis sammendrag
-
Steinnes, Lasse; Cascella, Michele & Hjorth-Jensen, Morten (2022). Electrostatics in Mesoscale Simulations of Biological Membranes using the Hybrid-Particle Field Approach. Universitetet i Oslo.
-
Ledum, Morten; Cascella, Michele & Gauss, Jurgen (2022). Hamiltonian hybrid particle-field method for biological soft matter: Efficient simulation and machine learning approaches. Department of Chemistry, Faculty of Mathematics and Natural Sciences, University of Oslo. ISSN 1501-7710. 2022(2516). Vis sammendrag
-
Bore, Sigbjørn Løland; Cascella, Michele & Kvaal, Simen (2020). Advances in the Hybrid Particle-Field Approach: Towards Biological Systems. Matematisk Naturvitenskapelig fakultet, Universitetet i Oslo. ISSN 1501-7710. 2020(2245). Vis sammendrag
-
Sekulic, Nikolina; Cascella, Michele & Hovet, Oda (2020). Molecular Dynamics Studies on the Essential Mitotic Protein Kinase – Aurora B. Universitetet i Oslo.
-
Peltzer, Raphael Mathias; Cascella, Michele; Pedersen, Thomas Bondo & Helgaker, Trygve (2018). Multi-scale computational modelling of bio-chemical systems in the condensed phase. Universitetet i Oslo. ISSN 1501-7710. 2018(2058).
-
Thorbjørnsrud, Helen Vikdal; Krengel, Ute & Cascella, Michele (2018). Escaping Mediocrity - Activity and Regulation of a Catalytically Inefficient Enzyme. Universistetet i Oslo. ISSN 1501-7710.
Publisert
4. feb. 2014 14:03
- Sist endret
18. aug. 2020 16:45