Membrane-Dependent Binding and Entry Mechanism of Dopamine into Its Receptor

Fabio Lolicato; Hanna Juhola; Agata Zak; Pekka A. Postila; Annina Saukko; Sami Rissanen; Giray Enkavi; Ilpo Vattulainen; Mariusz Kepczynski; Tomasz Rog

doi:10.1021/acschemneuro.9b00656

Membrane-Dependent Binding and Entry Mechanism of Dopamine into Its Receptor

Fabio Lolicato, Hanna Juhola, Agata Zak, Pekka A. Postila, Annina Saukko, Sami Rissanen, Giray Enkavi, Ilpo Vattulainen, Mariusz Kepczynski, Tomasz Rog

Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review

Originalspråk	engelska
Tidskrift	ACS chemical neuroscience
Volym	11
Nummer	13
Sidor (från-till)	1914-1924
Antal sidor	11
ISSN	1948-7193
DOI	https://doi.org/10.1021/acschemneuro.9b00656
Status	Publicerad - 1 juli 2020
MoE-publikationstyp	A1 Tidskriftsartikel-refererad

Vetenskapsgrenar

114 Fysik

Åtkomst av dokument

10.1021/acschemneuro.9b00656Licens: CC BY

acschemneuro.9b00656Slutlig publicerad version, 4,21 MBLicens: CC BY

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title = "Membrane-Dependent Binding and Entry Mechanism of Dopamine into Its Receptor",

keywords = "synaptic neurotransmission, ligand entry pathway prediction, lipid membrane, molecular dynamics, random acceleration molecular dynamics, umbrella sampling, PARTICLE MESH EWALD, ATOM FORCE-FIELD, MOLECULAR-DYNAMICS, POTENTIAL FUNCTIONS, MELATONIN, AFFINITY, PATHWAYS, CALCIUM, GROMACS, RELEASE, 114 Physical sciences",

author = "Fabio Lolicato and Hanna Juhola and Agata Zak and Postila, {Pekka A.} and Annina Saukko and Sami Rissanen and Giray Enkavi and Ilpo Vattulainen and Mariusz Kepczynski and Tomasz Rog",

year = "2020",

month = jul,

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doi = "10.1021/acschemneuro.9b00656",

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journal = "ACS chemical neuroscience",

issn = "1948-7193",

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AU - Lolicato, Fabio

AU - Juhola, Hanna

AU - Zak, Agata

AU - Postila, Pekka A.

AU - Saukko, Annina

AU - Rissanen, Sami

AU - Enkavi, Giray

AU - Vattulainen, Ilpo

AU - Kepczynski, Mariusz

AU - Rog, Tomasz

PY - 2020/7/1

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KW - synaptic neurotransmission

KW - ligand entry pathway prediction

KW - lipid membrane

KW - molecular dynamics

KW - random acceleration molecular dynamics

KW - umbrella sampling

KW - PARTICLE MESH EWALD

KW - ATOM FORCE-FIELD

KW - MOLECULAR-DYNAMICS

KW - POTENTIAL FUNCTIONS

KW - MELATONIN

KW - AFFINITY

KW - PATHWAYS

KW - CALCIUM

KW - GROMACS

KW - RELEASE

KW - 114 Physical sciences

U2 - 10.1021/acschemneuro.9b00656

DO - 10.1021/acschemneuro.9b00656

M3 - Article

VL - 11

SP - 1914

EP - 1924

JO - ACS chemical neuroscience

JF - ACS chemical neuroscience

SN - 1948-7193

IS - 13

ER -