id sid tid token lemma pos mc87pn91r8k 1 1 octopamine octopamine NOUN mc87pn91r8k 1 2 receptors receptor NOUN mc87pn91r8k 1 3 ( ( PUNCT mc87pn91r8k 1 4 oars oar NOUN mc87pn91r8k 1 5 ) ) PUNCT mc87pn91r8k 1 6 perform perform VERB mc87pn91r8k 1 7 key key ADJ mc87pn91r8k 1 8 operations operation NOUN mc87pn91r8k 1 9 in in ADP mc87pn91r8k 1 10 the the DET mc87pn91r8k 1 11 biological biological ADJ mc87pn91r8k 1 12 pathways pathway NOUN mc87pn91r8k 1 13 of of ADP mc87pn91r8k 1 14 invertebrates invertebrate NOUN mc87pn91r8k 1 15 only only ADV mc87pn91r8k 1 16 , , PUNCT mc87pn91r8k 1 17 making make VERB mc87pn91r8k 1 18 this this DET mc87pn91r8k 1 19 class class NOUN mc87pn91r8k 1 20 of of ADP mc87pn91r8k 1 21 g g NOUN mc87pn91r8k 1 22 - - PUNCT mc87pn91r8k 1 23 protein protein NOUN mc87pn91r8k 1 24 coupled couple VERB mc87pn91r8k 1 25 receptors receptor NOUN mc87pn91r8k 1 26 ( ( PUNCT mc87pn91r8k 1 27 gpcrs gpcrs PROPN mc87pn91r8k 1 28 ) ) PUNCT mc87pn91r8k 1 29 a a DET mc87pn91r8k 1 30 potentially potentially ADV mc87pn91r8k 1 31 good good ADJ mc87pn91r8k 1 32 target target NOUN mc87pn91r8k 1 33 for for ADP mc87pn91r8k 1 34 insecticides insecticide NOUN mc87pn91r8k 1 35 . . PUNCT mc87pn91r8k 2 1 however however ADV mc87pn91r8k 2 2 , , PUNCT mc87pn91r8k 2 3 the the DET mc87pn91r8k 2 4 lack lack NOUN mc87pn91r8k 2 5 of of ADP mc87pn91r8k 2 6 structural structural ADJ mc87pn91r8k 2 7 and and CCONJ mc87pn91r8k 2 8 experimental experimental ADJ mc87pn91r8k 2 9 data datum NOUN mc87pn91r8k 2 10 for for ADP mc87pn91r8k 2 11 this this DET mc87pn91r8k 2 12 insect insect NOUN mc87pn91r8k 2 13 - - PUNCT mc87pn91r8k 2 14 essential essential ADJ mc87pn91r8k 2 15 gpcr gpcr ADJ mc87pn91r8k 2 16 class class NOUN mc87pn91r8k 2 17 has have AUX mc87pn91r8k 2 18 promoted promote VERB mc87pn91r8k 2 19 the the DET mc87pn91r8k 2 20 development development NOUN mc87pn91r8k 2 21 of of ADP mc87pn91r8k 2 22 homology homology NOUN mc87pn91r8k 2 23 models model NOUN mc87pn91r8k 2 24 that that PRON mc87pn91r8k 2 25 are be AUX mc87pn91r8k 2 26 good good ADJ mc87pn91r8k 2 27 representations representation NOUN mc87pn91r8k 2 28 of of ADP mc87pn91r8k 2 29 their their PRON mc87pn91r8k 2 30 biological biological ADJ mc87pn91r8k 2 31 equivalents equivalent NOUN mc87pn91r8k 2 32 and and CCONJ mc87pn91r8k 2 33 will will AUX mc87pn91r8k 2 34 thus thus ADV mc87pn91r8k 2 35 be be AUX mc87pn91r8k 2 36 useful useful ADJ mc87pn91r8k 2 37 in in ADP mc87pn91r8k 2 38 the the DET mc87pn91r8k 2 39 development development NOUN mc87pn91r8k 2 40 of of ADP mc87pn91r8k 2 41 an an DET mc87pn91r8k 2 42 insecticide insecticide NOUN mc87pn91r8k 2 43 . . PUNCT mc87pn91r8k 3 1 i i PRON mc87pn91r8k 3 2 report report VERB mc87pn91r8k 3 3 here here ADV mc87pn91r8k 3 4 the the DET mc87pn91r8k 3 5 functional functional ADJ mc87pn91r8k 3 6 characterization characterization NOUN mc87pn91r8k 3 7 of of ADP mc87pn91r8k 3 8 two two NUM mc87pn91r8k 3 9 anopheles anophele NOUN mc87pn91r8k 3 10 gambiae gambiae NOUN mc87pn91r8k 3 11 oars oar NOUN mc87pn91r8k 3 12 and and CCONJ mc87pn91r8k 3 13 the the DET mc87pn91r8k 3 14 discovery discovery NOUN mc87pn91r8k 3 15 of of ADP mc87pn91r8k 3 16 new new ADJ mc87pn91r8k 3 17 oar oar NOUN mc87pn91r8k 3 18 agonists agonist NOUN mc87pn91r8k 3 19 and and CCONJ mc87pn91r8k 3 20 antagonists antagonist NOUN mc87pn91r8k 3 21 based base VERB mc87pn91r8k 3 22 on on ADP mc87pn91r8k 3 23 virtual virtual ADJ mc87pn91r8k 3 24 screening screening NOUN mc87pn91r8k 3 25 and and CCONJ mc87pn91r8k 3 26 molecular molecular ADJ mc87pn91r8k 3 27 dynamics dynamic NOUN mc87pn91r8k 3 28 ( ( PUNCT mc87pn91r8k 3 29 md md PROPN mc87pn91r8k 3 30 ) ) PUNCT mc87pn91r8k 3 31 simulations simulation NOUN mc87pn91r8k 3 32 . . PUNCT mc87pn91r8k 4 1 experimental experimental ADJ mc87pn91r8k 4 2 validation validation NOUN mc87pn91r8k 4 3 of of ADP mc87pn91r8k 4 4 the the DET mc87pn91r8k 4 5 results result NOUN mc87pn91r8k 4 6 shows show VERB mc87pn91r8k 4 7 the the DET mc87pn91r8k 4 8 accuracy accuracy NOUN mc87pn91r8k 4 9 of of ADP mc87pn91r8k 4 10 the the DET mc87pn91r8k 4 11 model model NOUN mc87pn91r8k 4 12 . . PUNCT mc87pn91r8k 5 1 supporting support VERB mc87pn91r8k 5 2 prior prior ADJ mc87pn91r8k 5 3 gpcr gpcr ADJ mc87pn91r8k 5 4 studies study NOUN mc87pn91r8k 5 5 , , PUNCT mc87pn91r8k 5 6 asp100 asp100 PROPN mc87pn91r8k 5 7 in in ADP mc87pn91r8k 5 8 the the DET mc87pn91r8k 5 9 tm3 tm3 NOUN mc87pn91r8k 5 10 region region NOUN mc87pn91r8k 5 11 , , PUNCT mc87pn91r8k 5 12 and and CCONJ mc87pn91r8k 5 13 ser206 ser206 PROPN mc87pn91r8k 5 14 and and CCONJ mc87pn91r8k 5 15 ser210 ser210 PROPN mc87pn91r8k 5 16 in in ADP mc87pn91r8k 5 17 the the DET mc87pn91r8k 5 18 tm5 tm5 NOUN mc87pn91r8k 5 19 region region NOUN mc87pn91r8k 5 20 were be AUX mc87pn91r8k 5 21 found find VERB mc87pn91r8k 5 22 to to PART mc87pn91r8k 5 23 be be AUX mc87pn91r8k 5 24 important important ADJ mc87pn91r8k 5 25 to to ADP mc87pn91r8k 5 26 the the DET mc87pn91r8k 5 27 activation activation NOUN mc87pn91r8k 5 28 of of ADP mc87pn91r8k 5 29 the the DET mc87pn91r8k 5 30 protein protein NOUN mc87pn91r8k 5 31 . . PUNCT mc87pn91r8k 6 1 the the DET mc87pn91r8k 6 2 current current ADJ mc87pn91r8k 6 3 combined combined ADJ mc87pn91r8k 6 4 computational computational ADJ mc87pn91r8k 6 5 and and CCONJ mc87pn91r8k 6 6 experimental experimental ADJ mc87pn91r8k 6 7 approach approach NOUN mc87pn91r8k 6 8 seems seem VERB mc87pn91r8k 6 9 appropriate appropriate ADJ mc87pn91r8k 6 10 for for ADP mc87pn91r8k 6 11 creating create VERB mc87pn91r8k 6 12 and and CCONJ mc87pn91r8k 6 13 refining refining NOUN mc87pn91r8k 6 14 homology homology NOUN mc87pn91r8k 6 15 models model NOUN mc87pn91r8k 6 16 of of ADP mc87pn91r8k 6 17 the the DET mc87pn91r8k 6 18 octopamine octopamine ADJ mc87pn91r8k 6 19 receptor receptor NOUN mc87pn91r8k 6 20 and and CCONJ mc87pn91r8k 6 21 in in ADP mc87pn91r8k 6 22 turn turn NOUN mc87pn91r8k 6 23 aid aid NOUN mc87pn91r8k 6 24 in in ADP mc87pn91r8k 6 25 the the DET mc87pn91r8k 6 26 discovery discovery NOUN mc87pn91r8k 6 27 of of ADP mc87pn91r8k 6 28 new new ADJ mc87pn91r8k 6 29 and and CCONJ mc87pn91r8k 6 30 effective effective ADJ mc87pn91r8k 6 31 insecticides.improvements insecticides.improvement NOUN mc87pn91r8k 6 32 can can AUX mc87pn91r8k 6 33 be be AUX mc87pn91r8k 6 34 made make VERB mc87pn91r8k 6 35 to to ADP mc87pn91r8k 6 36 the the DET mc87pn91r8k 6 37 virtual virtual ADJ mc87pn91r8k 6 38 screening screening NOUN mc87pn91r8k 6 39 procedure procedure NOUN mc87pn91r8k 6 40 by by ADP mc87pn91r8k 6 41 allowing allow VERB mc87pn91r8k 6 42 the the DET mc87pn91r8k 6 43 protein protein NOUN mc87pn91r8k 6 44 to to PART mc87pn91r8k 6 45 fully fully ADV mc87pn91r8k 6 46 assume assume VERB mc87pn91r8k 6 47 its its PRON mc87pn91r8k 6 48 active active ADJ mc87pn91r8k 6 49 and and CCONJ mc87pn91r8k 6 50 inactive inactive ADJ mc87pn91r8k 6 51 states state NOUN mc87pn91r8k 6 52 . . PUNCT mc87pn91r8k 7 1 however however ADV mc87pn91r8k 7 2 , , PUNCT mc87pn91r8k 7 3 gpcrs gpcrs PROPN mc87pn91r8k 7 4 are be AUX mc87pn91r8k 7 5 large large ADJ mc87pn91r8k 7 6 proteins protein NOUN mc87pn91r8k 7 7 , , PUNCT mc87pn91r8k 7 8 are be AUX mc87pn91r8k 7 9 suspended suspend VERB mc87pn91r8k 7 10 in in ADP mc87pn91r8k 7 11 a a DET mc87pn91r8k 7 12 lipid lipid NOUN mc87pn91r8k 7 13 bilayer bilayer NOUN mc87pn91r8k 7 14 , , PUNCT mc87pn91r8k 7 15 and and CCONJ mc87pn91r8k 7 16 are be AUX mc87pn91r8k 7 17 activated activate VERB mc87pn91r8k 7 18 on on ADP mc87pn91r8k 7 19 the the DET mc87pn91r8k 7 20 millisecond millisecond NOUN mc87pn91r8k 7 21 timescale timescale NOUN mc87pn91r8k 7 22 , , PUNCT mc87pn91r8k 7 23 all all PRON mc87pn91r8k 7 24 of of ADP mc87pn91r8k 7 25 which which PRON mc87pn91r8k 7 26 make make VERB mc87pn91r8k 7 27 conventional conventional ADJ mc87pn91r8k 7 28 molecular molecular ADJ mc87pn91r8k 7 29 dynamics dynamic NOUN mc87pn91r8k 7 30 ( ( PUNCT mc87pn91r8k 7 31 md md PROPN mc87pn91r8k 7 32 ) ) PUNCT mc87pn91r8k 7 33 simulations simulation NOUN mc87pn91r8k 7 34 infeasible infeasible ADJ mc87pn91r8k 7 35 , , PUNCT mc87pn91r8k 7 36 even even ADV mc87pn91r8k 7 37 if if SCONJ mc87pn91r8k 7 38 run run VERB mc87pn91r8k 7 39 on on ADP mc87pn91r8k 7 40 large large ADJ mc87pn91r8k 7 41 supercomputers supercomputer NOUN mc87pn91r8k 7 42 . . PUNCT mc87pn91r8k 8 1 however however ADV mc87pn91r8k 8 2 , , PUNCT mc87pn91r8k 8 3 accelerated accelerate VERB mc87pn91r8k 8 4 molecular molecular ADJ mc87pn91r8k 8 5 dynamics dynamic NOUN mc87pn91r8k 8 6 ( ( PUNCT mc87pn91r8k 8 7 amd amd PROPN mc87pn91r8k 8 8 ) ) PUNCT mc87pn91r8k 8 9 simulations simulation NOUN mc87pn91r8k 8 10 can can AUX mc87pn91r8k 8 11 reduce reduce VERB mc87pn91r8k 8 12 this this DET mc87pn91r8k 8 13 timescale timescale NOUN mc87pn91r8k 8 14 to to ADP mc87pn91r8k 8 15 even even ADV mc87pn91r8k 8 16 hundreds hundred NOUN mc87pn91r8k 8 17 of of ADP mc87pn91r8k 8 18 nanoseconds nanosecond NOUN mc87pn91r8k 8 19 , , PUNCT mc87pn91r8k 8 20 while while SCONJ mc87pn91r8k 8 21 running run VERB mc87pn91r8k 8 22 the the DET mc87pn91r8k 8 23 simulations simulation NOUN mc87pn91r8k 8 24 on on ADP mc87pn91r8k 8 25 graphics graphic NOUN mc87pn91r8k 8 26 processing processing NOUN mc87pn91r8k 8 27 units unit NOUN mc87pn91r8k 8 28 ( ( PUNCT mc87pn91r8k 8 29 gpus gpus X mc87pn91r8k 8 30 ) ) PUNCT mc87pn91r8k 8 31 would would AUX mc87pn91r8k 8 32 enable enable VERB mc87pn91r8k 8 33 even even ADV mc87pn91r8k 8 34 small small ADJ mc87pn91r8k 8 35 clusters cluster NOUN mc87pn91r8k 8 36 of of ADP mc87pn91r8k 8 37 gpus gpus PROPN mc87pn91r8k 8 38 to to PART mc87pn91r8k 8 39 have have VERB mc87pn91r8k 8 40 processing processing NOUN mc87pn91r8k 8 41 power power NOUN mc87pn91r8k 8 42 equivalent equivalent ADJ mc87pn91r8k 8 43 to to ADP mc87pn91r8k 8 44 hundreds hundred NOUN mc87pn91r8k 8 45 of of ADP mc87pn91r8k 8 46 cpus cpu NOUN mc87pn91r8k 8 47 . . PUNCT mc87pn91r8k 9 1 my my PRON mc87pn91r8k 9 2 results result NOUN mc87pn91r8k 9 3 show show VERB mc87pn91r8k 9 4 that that SCONJ mc87pn91r8k 9 5 amd amd NOUN mc87pn91r8k 9 6 simulations simulation NOUN mc87pn91r8k 9 7 run run VERB mc87pn91r8k 9 8 on on ADP mc87pn91r8k 9 9 gpus gpu NOUN mc87pn91r8k 9 10 can can AUX mc87pn91r8k 9 11 successfully successfully ADV mc87pn91r8k 9 12 obtain obtain VERB mc87pn91r8k 9 13 the the DET mc87pn91r8k 9 14 active active ADJ mc87pn91r8k 9 15 and and CCONJ mc87pn91r8k 9 16 inactive inactive ADJ mc87pn91r8k 9 17 state state NOUN mc87pn91r8k 9 18 conformations conformation NOUN mc87pn91r8k 9 19 of of ADP mc87pn91r8k 9 20 a a DET mc87pn91r8k 9 21 gpcr gpcr NOUN mc87pn91r8k 9 22 on on ADP mc87pn91r8k 9 23 this this DET mc87pn91r8k 9 24 reduced reduce VERB mc87pn91r8k 9 25 timescale timescale NOUN mc87pn91r8k 9 26 . . PUNCT mc87pn91r8k 10 1 furthermore furthermore ADV mc87pn91r8k 10 2 , , PUNCT mc87pn91r8k 10 3 i i PRON mc87pn91r8k 10 4 discovered discover VERB mc87pn91r8k 10 5 a a DET mc87pn91r8k 10 6 potential potential ADJ mc87pn91r8k 10 7 alternate alternate ADJ mc87pn91r8k 10 8 active active ADJ mc87pn91r8k 10 9 - - PUNCT mc87pn91r8k 10 10 state state NOUN mc87pn91r8k 10 11 agonist agonist NOUN mc87pn91r8k 10 12 - - PUNCT mc87pn91r8k 10 13 binding bind VERB mc87pn91r8k 10 14 position position NOUN mc87pn91r8k 10 15 in in ADP mc87pn91r8k 10 16 the the DET mc87pn91r8k 10 17 octopamine octopamine ADJ mc87pn91r8k 10 18 receptor receptor NOUN mc87pn91r8k 10 19 which which PRON mc87pn91r8k 10 20 has have VERB mc87pn91r8k 10 21 yet yet ADV mc87pn91r8k 10 22 to to PART mc87pn91r8k 10 23 be be AUX mc87pn91r8k 10 24 observed observe VERB mc87pn91r8k 10 25 and and CCONJ mc87pn91r8k 10 26 may may AUX mc87pn91r8k 10 27 be be AUX mc87pn91r8k 10 28 a a DET mc87pn91r8k 10 29 novel novel ADJ mc87pn91r8k 10 30 gpcr gpcr ADJ mc87pn91r8k 10 31 agonist agonist NOUN mc87pn91r8k 10 32 - - PUNCT mc87pn91r8k 10 33 binding bind VERB mc87pn91r8k 10 34 position position NOUN mc87pn91r8k 10 35 . . PUNCT mc87pn91r8k 11 1 these these DET mc87pn91r8k 11 2 results result NOUN mc87pn91r8k 11 3 demonstrate demonstrate VERB mc87pn91r8k 11 4 that that SCONJ mc87pn91r8k 11 5 a a DET mc87pn91r8k 11 6 complex complex ADJ mc87pn91r8k 11 7 biological biological ADJ mc87pn91r8k 11 8 system system NOUN mc87pn91r8k 11 9 with with ADP mc87pn91r8k 11 10 an an DET mc87pn91r8k 11 11 activation activation NOUN mc87pn91r8k 11 12 process process NOUN mc87pn91r8k 11 13 on on ADP mc87pn91r8k 11 14 the the DET mc87pn91r8k 11 15 millisecond millisecond NOUN mc87pn91r8k 11 16 timescale timescale NOUN mc87pn91r8k 11 17 can can AUX mc87pn91r8k 11 18 be be AUX mc87pn91r8k 11 19 successfully successfully ADV mc87pn91r8k 11 20 simulated simulate VERB mc87pn91r8k 11 21 on on ADP mc87pn91r8k 11 22 the the DET mc87pn91r8k 11 23 nanosecond nanosecond ADJ mc87pn91r8k 11 24 timescale timescale NOUN mc87pn91r8k 11 25 using use VERB mc87pn91r8k 11 26 a a DET mc87pn91r8k 11 27 simple simple ADJ mc87pn91r8k 11 28 computing computing NOUN mc87pn91r8k 11 29 system system NOUN mc87pn91r8k 11 30 consisting consist VERB mc87pn91r8k 11 31 of of ADP mc87pn91r8k 11 32 a a DET mc87pn91r8k 11 33 small small ADJ mc87pn91r8k 11 34 number number NOUN mc87pn91r8k 11 35 of of ADP mc87pn91r8k 11 36 gpus gpu NOUN mc87pn91r8k 11 37 . . PUNCT