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Publications

None. None. None. None. doi: psybias.


Receptor Uniprot entry name Uniprot ID Family Class PDB ID State Species Model type Ligand(s) Model name Num. of atoms Membrane composition Accum. sim. time (µs) Software Force field Submitted by
5-hydroxytryptamine receptor 2a 5ht2a_human P28223 5-Hydroxytryptamine receptors A 6WHA Active Homo sapiens Complex 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1h-indol-3-yl]etha... 5-hydroxytryptamine receptor 2a chimera in complex with CE... 78979 POPC 1.50 ACEMD3 GPUGRID CHARMM c36 Jul 2020 David Aranda, IMIM Report
5-hydroxytryptamine receptor 2a 5ht2a_human P28223 5-Hydroxytryptamine receptors A 6WHA Active Homo sapiens Complex 2-(5-nitro-1h-indol-3-yl)ethanamine 5-hydroxytryptamine receptor 2a chimera in complex with GP... 78959 POPC 1.50 ACEMD3 GPUGRID CHARMM c36 Jul 2020 David Aranda, IMIM Report
5-hydroxytryptamine receptor 2a 5ht2a_human P28223 5-Hydroxytryptamine receptors A 6WHA Active Homo sapiens Complex 1h-indol-5-ol, 3-(2-aminoethyl)-1-methyl- 5-hydroxytryptamine receptor 2a chimera in complex with RL... 78958 POPC 1.50 ACEMD3 GPUGRID CHARMM c36 Jul 2020 David Aranda, IMIM Report
5-hydroxytryptamine receptor 2a 5ht2a_human P28223 5-Hydroxytryptamine receptors A 6WHA Active Homo sapiens Complex 1h-indole, 3-(2-aminoethyl)-5-phenoxy- 5-hydroxytryptamine receptor 2a chimera in complex with ZU... 78962 POPC 1.50 ACEMD3 GPUGRID CHARMM c36 Jul 2020 David Aranda, IMIM Report

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