RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN4819 | MAT-POS-b3e365b9-1_1 | EN300-23223_3_1_1 | −1.2 ± 0.3 | ||||||||
RUN6301 | MAT-POS-b3e365b9-1_1 | EN300-132624_2_1_1 | −1.2 ± 0.3 | ||||||||
RUN5481 | MAT-POS-b3e365b9-1_1 | EN300-72730_1_2_1 | −1.1 ± 0.2 | ||||||||
RUN4465 | MAT-POS-b3e365b9-1_1 | EN300-6082676_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN5293 | MAT-POS-b3e365b9-1_1 | EN300-55109_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN5201 | MAT-POS-b3e365b9-1_1 | EN300-05512_2_1_1 | −1.1 ± 0.3 | ||||||||
RUN3381 | MAT-POS-b3e365b9-1_1 | EN300-00904_1_1_2 | −1.1 ± 0.3 | ||||||||
RUN6884 | MAT-POS-b3e365b9-1_1 | EN300-94945_3_1_1 | −1.1 ± 0.3 | ||||||||
RUN3858 | MAT-POS-b3e365b9-1_1 | EN300-128463_3_1_1 | −1.1 ± 0.3 | ||||||||
RUN4926 | MAT-POS-b3e365b9-1_1 | EN300-1448603_3_2_1 | −1.1 ± 0.3 | ||||||||
RUN6613 | MAT-POS-b3e365b9-1_1 | EN300-1630093_1_2_1 | −1.1 ± 0.3 | ||||||||
RUN5904 | MAT-POS-b3e365b9-1_1 | EN300-72896_3_1_1 | −1.1 ± 0.3 | ||||||||
RUN3018 | MAT-POS-b3e365b9-1_1 | EN300-211203_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN5780 | MAT-POS-b3e365b9-1_1 | EN300-7473354_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN3982 | MAT-POS-b3e365b9-1_1 | EN300-1718364_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN7140 | MAT-POS-b3e365b9-1_1 | EN300-1605226_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN3594 | MAT-POS-b3e365b9-1_1 | EN300-123614_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN3216 | MAT-POS-b3e365b9-1_1 | EN300-1138792_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN4718 | MAT-POS-b3e365b9-1_1 | EN300-7003350_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN7520 | MAT-POS-b3e365b9-1_1 | EN300-373476_1_2_1 | −1.1 ± 0.3 | ||||||||
RUN4850 | MAT-POS-b3e365b9-1_1 | EN300-158260_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN2458 | MAT-POS-b3e365b9-1_1 | EDJ-MED-d203f206-34_1 | −1.1 ± 0.3 | ||||||||
RUN299 | MAT-POS-b3e365b9-1_1 | PET-UNK-cf04cb02-1_2 | −1.1 ± 0.4 | ||||||||
RUN5095 | MAT-POS-b3e365b9-1_1 | EN300-1654606_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN3607 | MAT-POS-b3e365b9-1_1 | EN300-1253122_2_1_1 | −1.1 ± 0.3 | ||||||||
RUN5942 | MAT-POS-b3e365b9-1_1 | EN300-188356_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN3069 | MAT-POS-b3e365b9-1_1 | EN300-7436306_3_1_2 | −1.1 ± 0.3 | ||||||||
RUN4612 | MAT-POS-b3e365b9-1_1 | EN300-1709410_1_2_1 | −1.1 ± 0.3 | ||||||||
RUN3327 | MAT-POS-b3e365b9-1_1 | EN300-90225_2_1_1 | −1.1 ± 0.2 | ||||||||
RUN5650 | MAT-POS-b3e365b9-1_1 | EN300-7444533_3_4_1 | −1.1 ± 0.4 | ||||||||
RUN3859 | MAT-POS-b3e365b9-1_1 | EN300-748981_3_1_1 | −1.1 ± 0.3 | ||||||||
RUN5248 | MAT-POS-b3e365b9-1_1 | EN300-259694_1_2_1 | −1.1 ± 0.3 | ||||||||
RUN4203 | MAT-POS-b3e365b9-1_1 | EN300-306026_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN6292 | MAT-POS-b3e365b9-1_1 | EN300-7493296_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN4697 | MAT-POS-b3e365b9-1_1 | EN300-300217_1_2_1 | −1.1 ± 0.3 | ||||||||
RUN4927 | MAT-POS-b3e365b9-1_1 | EN300-124301_3_1_1 | −1.1 ± 0.3 | ||||||||
RUN5858 | MAT-POS-b3e365b9-1_1 | EN300-68747_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN7548 | MAT-POS-b3e365b9-1_1 | EN300-48902_3_2_1 | −1.1 ± 0.4 | ||||||||
RUN7491 | MAT-POS-b3e365b9-1_1 | EN300-25572_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN4329 | MAT-POS-b3e365b9-1_1 | EN300-246992_1_2_1 | −1.1 ± 0.2 | ||||||||
RUN3051 | MAT-POS-b3e365b9-1_1 | EN300-25446_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN5245 | MAT-POS-b3e365b9-1_1 | EN300-19700_2_1_1 | −1.1 ± 0.2 | ||||||||
RUN7008 | MAT-POS-b3e365b9-1_1 | EN300-1725538_1_2_1 | −1.1 ± 0.3 | ||||||||
RUN3699 | MAT-POS-b3e365b9-1_1 | EN300-181938_1_1_1 | −1.1 ± 0.3 | ||||||||
RUN4434 | MAT-POS-b3e365b9-1_1 | EN300-258702_3_1_1 | −1.1 ± 0.3 | ||||||||
RUN5119 | MAT-POS-b3e365b9-1_1 | EN300-123489_1_1_1 | −1.1 ± 0.2 | ||||||||
RUN6764 | MAT-POS-b3e365b9-1_1 | EN300-393148_1_1_1 | −1.1 ± 0.3 |