Federico Comitani

138

Citations

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Dive into the research topics where Federico Comitani is active. These topic labels come from the works of this person. Together they form a unique fingerprint.

1 Similar Profiles

5 Article
4 Other contribution
1 Letter
1 Review article

Simulation data I (molecular dynamics) for 'Trans–Cis Proline Switches in a Pentameric Ligand-Gated Ion Channel - How They Are Affected by and How They Affect the Biomolecular Environment', J. Chem. Phys. Lett. 10, 694 (2019)
Molteni, C., Crnjar, A., Comitani, F. & Hester, W., 2020
Research output: Other contribution

Open Access
Simulation data II (metadynamics) for 'Trans–Cis Proline Switches in a Pentameric Ligand-Gated Ion Channel - How They Are Affected by and How They Affect the Biomolecular Environment', J. Phys. Chem. Lett. 10, 694 (2019)
Molteni, C., Crnjar, A., Comitani, F. & Hester, W., 2020
Research output: Other contribution

Open Access
Mutagenesis Computer Experiments in Pentameric Ligand-Gated Ion Channels: the Role of Simulation Tools with Different Resolution
Crnjar, A., Comitani, F., Melis, C. & Molteni, C., 19 Apr 2019, In: Interface Focus. 9, 3, 20180067.
Research output: Contribution to journal › Review article › peer-review

Open Access
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11 Citations (Scopus)

115 Downloads (Pure)
Trans-cis proline switches in a pentameric ligand-gated ion channel: how they are affected by and how they affect the biomolecular environment
Crnjar, A., Comitani, F., Hester, W. & Molteni, C., 7 Feb 2019, In: Journal of physical chemistry letters. 10, 3, p. 694-700 7 p.
Research output: Contribution to journal › Letter › peer-review

Open Access
File
9 Citations (Scopus)

349 Downloads (Pure)
Data Files for Mapping the Conformational Free Energy of Aspartic Acid in the Gas Phase and in Aqueous Solution
Comitani, F., Rossi, K., Ceriotti, M., Sanz Gonzalez, M. E. & Molteni, C., 2017
Research output: Other contribution

Open Access

COMPUTATIONAL MODELLING OF ACTIVATION MECHANISMS IN LIGAND-GATED ION CHANNELS
Author: Comitani, F., 2017
Supervisor: Lorenz, C. (Supervisor) & Molteni, C. (Supervisor)
Student thesis: Doctoral Thesis › Doctor of Philosophy

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Federico Comitani

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Research output

Simulation data I (molecular dynamics) for 'Trans–Cis Proline Switches in a Pentameric Ligand-Gated Ion Channel - How They Are Affected by and How They Affect the Biomolecular Environment', J. Chem. Phys. Lett. 10, 694 (2019)

Simulation data II (metadynamics) for 'Trans–Cis Proline Switches in a Pentameric Ligand-Gated Ion Channel - How They Are Affected by and How They Affect the Biomolecular Environment', J. Phys. Chem. Lett. 10, 694 (2019)

Mutagenesis Computer Experiments in Pentameric Ligand-Gated Ion Channels: the Role of Simulation Tools with Different Resolution

Trans-cis proline switches in a pentameric ligand-gated ion channel: how they are affected by and how they affect the biomolecular environment

Data Files for Mapping the Conformational Free Energy of Aspartic Acid in the Gas Phase and in Aqueous Solution

Thesis

COMPUTATIONAL MODELLING OF ACTIVATION MECHANISMS IN LIGAND-GATED ION CHANNELS