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Stefan Doerr

Showing results (11-20 of 18) with videos related to

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Journal of Chemical Information and Modeling|September 11, 2023
NNP/MM: Accelerating Molecular Dynamics Simulations with Machine Learning Potentials and Molecular MechanicsRaimondas Galvelis, Alejandro Varela-Rial, Stefan Doerr, et al.
Arxiv|March 11, 2024
TorchMD-Net 2.0: Fast Neural Network Potentials for Molecular SimulationsRaul P Pelaez, Guillem Simeon, Raimondas Galvelis, et al.
Journal of Chemical Theory and Computation|May 14, 2024
TorchMD-Net 2.0: Fast Neural Network Potentials for Molecular SimulationsRaul P Pelaez, Guillem Simeon, Raimondas Galvelis, et al.
The Journal of Physical Chemistry. B|February 10, 2022
Membrane Composition and Raf[CRD]-Membrane Attachment Are Driving Forces for K-Ras4B Dimer StabilityIoannis Andreadelis, Sofia Kiriakidi, Christos Lamprakis, et al.
Nature Communications|September 15, 2023
Machine learning coarse-grained potentials of protein thermodynamicsMaciej Majewski, Adrià Pérez, Philipp Thölke, et al.
Scientific Reports|April 11, 2019
Author Correction: Dopamine D3 receptor antagonist reveals a cryptic pocket in aminergic GPCRsNoelia Ferruz, Stefan Doerr, Michelle A Vanase-Frawley, et al.
Scientific Reports|January 19, 2018
Dopamine D3 receptor antagonist reveals a cryptic pocket in aminergic GPCRsNoelia Ferruz, Stefan Doerr, Michelle A Vanase-Frawley, et al.
Philosophical Transactions of the Royal Society of London. Series B, Biological Sciences|April 17, 2025
Priority research directions for wildfire science: views from a historically fire-prone and an emerging fire-prone countryKerryn Little, Rayanne Vitali, Claire M Belcher, et al.
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Showing results (11-20 of 18) with videos related to

Sort By:
Pageof 2
You have reached the last page of results.This site can display upto 18 results.
Journal of Chemical Information and Modeling|September 11, 2023
NNP/MM: Accelerating Molecular Dynamics Simulations with Machine Learning Potentials and Molecular MechanicsRaimondas Galvelis, Alejandro Varela-Rial, Stefan Doerr, et al.
Arxiv|March 11, 2024
TorchMD-Net 2.0: Fast Neural Network Potentials for Molecular SimulationsRaul P Pelaez, Guillem Simeon, Raimondas Galvelis, et al.
Journal of Chemical Theory and Computation|May 14, 2024
TorchMD-Net 2.0: Fast Neural Network Potentials for Molecular SimulationsRaul P Pelaez, Guillem Simeon, Raimondas Galvelis, et al.
The Journal of Physical Chemistry. B|February 10, 2022
Membrane Composition and Raf[CRD]-Membrane Attachment Are Driving Forces for K-Ras4B Dimer StabilityIoannis Andreadelis, Sofia Kiriakidi, Christos Lamprakis, et al.
Nature Communications|September 15, 2023
Machine learning coarse-grained potentials of protein thermodynamicsMaciej Majewski, Adrià Pérez, Philipp Thölke, et al.
Scientific Reports|April 11, 2019
Author Correction: Dopamine D3 receptor antagonist reveals a cryptic pocket in aminergic GPCRsNoelia Ferruz, Stefan Doerr, Michelle A Vanase-Frawley, et al.
Scientific Reports|January 19, 2018
Dopamine D3 receptor antagonist reveals a cryptic pocket in aminergic GPCRsNoelia Ferruz, Stefan Doerr, Michelle A Vanase-Frawley, et al.
Philosophical Transactions of the Royal Society of London. Series B, Biological Sciences|April 17, 2025
Priority research directions for wildfire science: views from a historically fire-prone and an emerging fire-prone countryKerryn Little, Rayanne Vitali, Claire M Belcher, et al.
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