Model Inference: <model_name> <date>

[mariscalbrice]

Model

Antimalarial activity (ABS and sexual stages) - eos80ch

Molecules

O=C1C(CC(N2C(C)(C)COC2)=O)=C(C)C(C=CC(OCC(C)=C)=C3)=C3O1 O=C1N(CC2=CC=CN=C2)CCC3C(CCN(C(C(C)(C)C)=O)C3)C1 COCC(NCC1C=C(C(CC1C(C)C)CC(NCC2=CC=CN=C2)=O)C)=O O=C(NCC1=CC=CN=C1)CCC23CCC(O)(C)CC2C(C)(C)CC3NC(COC)=O CCN[C@@H]1CC@@HNC)O)[OH2+])O[C@H]3OC(CN)=CC[C@H]3N)N O=C(CNC(C(O)(C)C1=O)=O)NC(/C=C/C(N(C)CC(OC(CCCCCCCCCCCCC)C1C)=O)=O)=C O=C(NC1CCC2(C)C(C(O)C(C(C)C(NCCN3CCOCC3)=O)CC2)C1C)NCC CN1CC@HO OCCCCCC/C=C\CC(O)C(C1C(C(O)C(CO)N1)OC2C(O)C(O)C(O)C(CO)O2)O OC1(C)C(OC2C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(COC(C)=O)O2)C=C(C(C)C)CC1 O=C1C=C2CCC3C4C(C(C(C)OC(C)=O)CC4)(C)CCC3C2(C)C=C1 OC1C(OC(C)C(O)C1O)OC2=CC3=C(C(C(C(O4)=O)=CC(O)=C5OC)=C5OC3=O)C4=C2O O=C(O)C1=C(C)C(O)=C(C(C(C=C(O)C=C2O)=C2C3=O)=O)C3=C1O O=C(OC1CC(C(O)=CC(O)=C2)=C2OC1C3=CC(O)=C(OC)C(O)=C3)/C=C/C4=CC=C(O)C(OC)=C4 O=C(/C=C/C1=CC=CC=C1)OC(C(C2=CC(O)=C(O)C(O)=C2)O3)CC4=C3C=C(O)C=C4[OH2+] CC12C(C(CCC3C4(C)CCCC3(C)C)(C)C4CC2OC(C)=O)C=CC5=CN(CC(C)C)C=C15 CC(C)NH+CCNCC1C2C=C3C(C)CCCC3(C)CC2OC1=O CC1(CN2CC(C1=O)(C)C3)C[NH+]3C2C4=CC=C(CC)C=C4 CC1(C)OC(C)(C)C(C1C2=O)CC3=C2C=CC(N4)=C3C5=C4C6(C)C(C5)CCC7(O)C6(C)CCC8C7(O9)C9C(O)C(C(C)(O)C)O8 OC1=NC(C(C)C)C(O)=NC(CC(C)C)C(O)=NC(C)C(O)=NC(C)C(OC(C(C)CCCCCC)CC(O)=NC1)=O O/C1=N/C(C(C)C)/C(O)=N\C(CCCCCCCCC(C)CC)C/C(O)=N\C/C(O)=N\C1CCCN CC(/C=C\C1=C(C)CN(C)CC1)C2CCC3C4=CCC5C(O)C(N)CCC5(C)C4CCC32C CC1(C)C2CC(O)(C)CCC2(CCC(NC3CC3)=O)C(NCC4CCCCC4)C1 CC(C1)(C)C2C(CCC(C)(O)C2)(CCC(NC3CC3)=O)C1[NH2+]CC4CCCCC4 CC(NH+C)C1C2(C)CCC3C4(C)CCC(N5CC(C(C)C)C5=O)C(O)C4CCC3C2CC1 OC(C(C1C2CC(CCC3=C(C2)C=CC=C3)C(CCC/C=C\CCCCCC)C1CCN)C(O)=O)C O=C(C1=C(O)CCC(O)C1=O)CCCCCCCCCCCCCCCCC O=C(C1(C/C=C(C)/C)C(C)(C)C(/C=C/C(C)(O)C)C2)C(C(C3=CC(O)=C(O)C=C3)=O)=C4OC(C)(C)C(C/C=C(C)/C)CC42C1=O OC1C(C(C(OC)=O)CCC(C(C)C)=C)C2(C)CCC3=C(CCC4C3(C)CCC(OC(C)=O)C4(C)C)C2(C)C1 CCC1C=CCCC2(N=C3N4C(CCC4C2)C(C(OCCCCCCCCCCCCCCCCC(OC)=O)=O)C5(CCCC(O5)C)N3)O1 O=C(C1=CC=C(C(C)(C)C)C=C1)NCCCN(CC2)CCN2CCCNC(C3=CC=C(C(C)(C)C)C=C3)=O O=C(C(C1C(C(C=CC1C2(CCCCC2)C3=CC=CC=C3)CCC/C=C\CCC4CCCCC4)CCN)C(O)C)O OC1(C=CC2N1CCCN2CCCCNC(N)=N)CCCCCCCCCCCCCCC=C O=C(/C=C\C1=CC=C(O)C=C1)OC2CC3=CCC4C5C(C(C(C)CCC(C)C(C)C)CC5)(C)CCC4C3(C)CC2 O=C1C2(C(C)(C(CC(CC(C(C)(O3)C)C/C=C(C)\C)(C2=O)C3=C1C(C4=CC=C(C(O)=C4)O)=O)/C=C/C(C)=C)C)C/C=C(C)\C CC(C)(C@HCC@C(C)(C)O1)(C2=O)C1=C1C(c(cc3)cc(O)c3O)=O)[C@]2(CC=C(C)C)C1=O CC1C(CN(C)CC2CCCCC2)OC3=C(C=C(N(C)C)C=C3)C(N(C(C)CO)C1)=O CC12C(CCC3=C2CC(C)(C)CC3)(C)C(C4(COC(C)=O)CC1)CCC(C4CC5)(C)C(C)C5=O OC1CCC2(C)C3C4(C(CCC5C(/C=C/C(C(C)C)C)C)C5(C)CC3)C(O4)C(O)C2(O)C1 CC12CC=C3C4(C)CCC(O)C(C)(C)C4CC=C3C1(C)CCC2C(C(O)=O)CCC(C(C)C)=C OC(C(C(C)(O)C)OC1)CC1C2CCC3C4=CCC5C(CCC(O)C5(C)C)(C)C4CCC32C

[github-actions[bot]]

Greetings @mariscalbrice!

We have successfully completed your model inference run. You can download your results here

Please note that these results will only be available for 30 days after which they will be removed and this issue closed.

[github-actions[bot]]

Greetings! This is a friendly reminder that we only keep results for 30 days. If you have not downloaded your results, please do so within the next 5 days.

[github-actions[bot]]

This issue has reached the end of its lifecycle and is being closed and the associated data removed. Please feel free to submit a new issue if you need updated data.