RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN1 | MAT-POS-8a69d52e-7_1 | JOH-SUS-a69c159d-6_1 | −1.89 ± 0.07 | ||||||||
RUN1245 | MAT-POS-8a69d52e-7_1 | EN300-364679_1_1 | −1.9 ± 0.2 | ||||||||
RUN1221 | MAT-POS-8a69d52e-7_1 | EN300-52467_1_1 | −1.9 ± 0.2 | ||||||||
RUN14094 | MAT-POS-8a69d52e-7_1 | EN300-1932780_3_1 | −1.9 ± 0.2 | ||||||||
RUN3006 | MAT-POS-8a69d52e-7_1 | EN300-149975_1_1 | −1.9 ± 0.2 | ||||||||
RUN2561 | MAT-POS-8a69d52e-7_1 | EN300-4726186_1_2 | −1.9 ± 0.3 | ||||||||
RUN9388 | MAT-POS-8a69d52e-7_1 | EN300-1428769_1_1 | −1.9 ± 0.4 | ||||||||
RUN4849 | MAT-POS-8a69d52e-7_1 | EN300-6486793_3_1 | −1.9 ± 0.3 | ||||||||
RUN5370 | MAT-POS-8a69d52e-7_1 | EN300-396748_1_1 | −1.9 ± 0.2 | ||||||||
RUN2946 | MAT-POS-8a69d52e-7_1 | EN300-59478_1_1 | −1.9 ± 0.3 | ||||||||
RUN11629 | MAT-POS-8a69d52e-7_1 | EN300-7445890_1_3 | −1.9 ± 0.3 | ||||||||
RUN3134 | MAT-POS-8a69d52e-7_1 | EN300-379219_1_2 | −1.9 ± 0.2 | ||||||||
RUN8084 | MAT-POS-8a69d52e-7_1 | EN300-6497444_1_1 | −1.9 ± 0.2 | ||||||||
RUN14778 | MAT-POS-8a69d52e-7_1 | EN300-19926_3_1 | −1.9 ± 0.2 | ||||||||
RUN14053 | MAT-POS-8a69d52e-7_1 | EN300-211422_2_1 | −1.9 ± 0.2 | ||||||||
RUN7928 | MAT-POS-8a69d52e-7_1 | EN300-3044054_1_2 | −1.9 ± 0.2 | ||||||||
RUN9273 | MAT-POS-8a69d52e-7_1 | EN300-54837_1_1 | −1.9 ± 0.2 | ||||||||
RUN4822 | MAT-POS-8a69d52e-7_1 | EN300-2011083_1_2 | −1.9 ± 0.2 | ||||||||
RUN8027 | MAT-POS-8a69d52e-7_1 | EN300-217107_3_2 | −1.9 ± 0.2 | ||||||||
RUN1784 | MAT-POS-8a69d52e-7_1 | EN300-107267_3_1 | −1.9 ± 0.2 | ||||||||
RUN4709 | MAT-POS-8a69d52e-7_1 | EN300-13890_3_2 | −1.9 ± 0.3 | ||||||||
RUN7552 | MAT-POS-8a69d52e-7_1 | EN300-254121_1_2 | −1.8 ± 0.3 | ||||||||
RUN479 | MAT-POS-8a69d52e-7_1 | EN300-46832_1_2 | −1.8 ± 0.2 | ||||||||
RUN4781 | MAT-POS-8a69d52e-7_1 | EN300-697519_3_1 | −1.8 ± 0.2 | ||||||||
RUN6803 | MAT-POS-8a69d52e-7_1 | EN300-7439985_1_1 | −1.8 ± 0.2 | ||||||||
RUN14834 | MAT-POS-8a69d52e-7_1 | EN300-113234_3_2 | −1.8 ± 0.2 | ||||||||
RUN15222 | MAT-POS-8a69d52e-7_1 | EN300-7430501_3_2 | −1.8 ± 0.3 | ||||||||
RUN12024 | MAT-POS-8a69d52e-7_1 | EN300-60035_1_2 | −1.8 ± 0.2 | ||||||||
RUN8832 | MAT-POS-8a69d52e-7_1 | EN300-53918_3_1 | −1.8 ± 0.3 | ||||||||
RUN5222 | MAT-POS-8a69d52e-7_1 | EN300-133915_1_1 | −1.8 ± 0.2 | ||||||||
RUN2617 | MAT-POS-8a69d52e-7_1 | EN300-107267_2_1 | −1.8 ± 0.2 | ||||||||
RUN1237 | MAT-POS-8a69d52e-7_1 | EN300-52467_1_1 | −1.8 ± 0.2 | ||||||||
RUN2468 | MAT-POS-8a69d52e-7_1 | EN300-223284_1_1 | −1.8 ± 0.2 | ||||||||
RUN8965 | MAT-POS-8a69d52e-7_1 | EN300-1273016_1_1 | −1.8 ± 0.2 | ||||||||
RUN9724 | MAT-POS-8a69d52e-7_1 | EN300-7385389_1_1 | −1.8 ± 0.3 | ||||||||
RUN6177 | MAT-POS-8a69d52e-7_1 | EN300-108236_3_1 | −1.8 ± 0.3 | ||||||||
RUN3346 | MAT-POS-8a69d52e-7_1 | EN300-131572_1_1 | −1.8 ± 0.2 | ||||||||
RUN15379 | MAT-POS-8a69d52e-7_1 | EN300-1267109_3_1 | −1.8 ± 0.2 | ||||||||
RUN1273 | MAT-POS-8a69d52e-7_1 | EN300-82179_1_1 | −1.8 ± 0.2 | ||||||||
RUN4145 | MAT-POS-8a69d52e-7_1 | EN300-370792_1_1 | −1.8 ± 0.3 | ||||||||
RUN7172 | MAT-POS-8a69d52e-7_1 | EN300-251851_1_1 | −1.8 ± 0.3 | ||||||||
RUN1192 | MAT-POS-8a69d52e-7_1 | EN300-1968342_3_1 | −1.8 ± 0.2 | ||||||||
RUN8785 | MAT-POS-8a69d52e-7_1 | EN300-6482296_1_1 | −1.8 ± 0.3 | ||||||||
RUN8672 | MAT-POS-8a69d52e-7_1 | EN300-3710141_3_1 | −1.8 ± 0.2 | ||||||||
RUN5905 | MAT-POS-8a69d52e-7_1 | EN300-2009745_1_2 | −1.8 ± 0.2 | ||||||||
RUN2083 | MAT-POS-8a69d52e-7_1 | EN300-139167_1_2 | −1.8 ± 0.2 | ||||||||
RUN4486 | MAT-POS-8a69d52e-7_1 | EN300-151298_1_1 | −1.8 ± 0.2 | ||||||||
RUN9469 | MAT-POS-8a69d52e-7_1 | EN300-11714_1_1 | −1.8 ± 0.2 | ||||||||
RUN9004 | MAT-POS-8a69d52e-7_1 | EN300-4698402_3_1 | −1.8 ± 0.2 | ||||||||
RUN9775 | MAT-POS-8a69d52e-7_1 | EN300-1704404_1_1 | −1.8 ± 0.3 | ||||||||
RUN1568 | MAT-POS-8a69d52e-7_1 | EN300-6736413_3_1 | −1.8 ± 0.2 | ||||||||
RUN1088 | MAT-POS-8a69d52e-7_1 | EN300-18249_3_1 | −1.8 ± 0.2 | ||||||||
RUN1409 | MAT-POS-8a69d52e-7_1 | EN300-123712_1_1 | −1.8 ± 0.2 | ||||||||
RUN2431 | MAT-POS-8a69d52e-7_1 | EN300-22879_1_2 | −1.8 ± 0.3 | ||||||||
RUN7308 | MAT-POS-8a69d52e-7_1 | EN300-36158_1_1 | −1.8 ± 0.2 | ||||||||
RUN2309 | MAT-POS-8a69d52e-7_1 | EN300-6482296_1_8 | −1.8 ± 0.3 | ||||||||
RUN12364 | MAT-POS-8a69d52e-7_1 | EN300-90531_1_3 | −1.8 ± 0.3 | ||||||||
RUN8116 | MAT-POS-8a69d52e-7_1 | EN300-1723663_1_1 | −1.8 ± 0.3 | ||||||||
RUN13790 | MAT-POS-8a69d52e-7_1 | EN300-6479181_3_4 | −1.8 ± 0.3 | ||||||||
RUN1457 | MAT-POS-8a69d52e-7_1 | EN300-10170_1_2 | −1.8 ± 0.3 | ||||||||
RUN411 | MAT-POS-8a69d52e-7_1 | EN300-7355519_1_6 | −1.8 ± 0.2 | ||||||||
RUN8861 | MAT-POS-8a69d52e-7_1 | EN300-7385329_1_2 | −1.8 ± 0.2 | ||||||||
RUN2004 | MAT-POS-8a69d52e-7_1 | EN300-1715993_1_1 | −1.8 ± 0.2 | ||||||||
RUN5137 | MAT-POS-8a69d52e-7_1 | EN300-379533_1_1 | −1.8 ± 0.2 | ||||||||
RUN11128 | MAT-POS-8a69d52e-7_1 | EN300-69070_3_1 | −1.8 ± 0.2 | ||||||||
RUN5697 | MAT-POS-8a69d52e-7_1 | EN300-171752_1_1 | −1.8 ± 0.2 | ||||||||
RUN4914 | MAT-POS-8a69d52e-7_1 | EN300-53423_1_1 | −1.8 ± 0.2 | ||||||||
RUN15316 | MAT-POS-8a69d52e-7_1 | EN300-2910941_3_1 | −1.8 ± 0.3 | ||||||||
RUN9533 | MAT-POS-8a69d52e-7_1 | EN300-186943_1_1 | −1.8 ± 0.2 | ||||||||
RUN9380 | MAT-POS-8a69d52e-7_1 | EN300-157830_1_2 | −1.8 ± 0.3 | ||||||||
RUN8792 | MAT-POS-8a69d52e-7_1 | EN300-154942_3_1 | −1.8 ± 0.2 | ||||||||
RUN9353 | MAT-POS-8a69d52e-7_1 | EN300-6474341_1_2 | −1.8 ± 0.2 | ||||||||
RUN1847 | MAT-POS-8a69d52e-7_1 | EN300-139167_3_2 | −1.8 ± 0.2 | ||||||||
RUN420 | MAT-POS-8a69d52e-7_1 | EN300-6494158_2_1 | −1.8 ± 0.2 | ||||||||
RUN5613 | MAT-POS-8a69d52e-7_1 | EN300-1719075_1_1 | −1.8 ± 0.3 | ||||||||
RUN3061 | MAT-POS-8a69d52e-7_1 | EN300-65063_1_1 | −1.8 ± 0.3 | ||||||||
RUN919 | MAT-POS-8a69d52e-7_1 | EN300-7463171_1_1 | −1.8 ± 0.4 | ||||||||
RUN8917 | MAT-POS-8a69d52e-7_1 | EN300-75342_1_1 | −1.8 ± 0.2 | ||||||||
RUN14204 | MAT-POS-8a69d52e-7_1 | EN300-1644723_3_3 | −1.8 ± 0.2 | ||||||||
RUN1370 | MAT-POS-8a69d52e-7_1 | EN300-139167_2_1 | −1.8 ± 0.2 | ||||||||
RUN407 | MAT-POS-8a69d52e-7_1 | EN300-310888_1_1 | −1.8 ± 0.2 | ||||||||
RUN480 | MAT-POS-8a69d52e-7_1 | EN300-704039_2_2 | −1.8 ± 0.3 | ||||||||
RUN1217 | MAT-POS-8a69d52e-7_1 | EN300-146051_1_1 | −1.8 ± 0.2 | ||||||||
RUN3093 | MAT-POS-8a69d52e-7_1 | EN300-7459540_1_3 | −1.8 ± 0.4 | ||||||||
RUN13543 | MAT-POS-8a69d52e-7_1 | EN300-741926_2_2 | −1.8 ± 0.2 | ||||||||
RUN9877 | MAT-POS-8a69d52e-7_1 | EN300-06030_1_1 | −1.8 ± 0.2 | ||||||||
RUN3 | MAT-POS-8a69d52e-7_1 | JOH-SUS-a69c159d-7_1 | −1.76 ± 0.07 | ||||||||
RUN1754 | MAT-POS-8a69d52e-7_1 | EN300-203293_2_1 | −1.8 ± 0.2 | ||||||||
RUN5082 | MAT-POS-8a69d52e-7_1 | EN300-1662365_1_2 | −1.8 ± 0.2 | ||||||||
RUN3062 | MAT-POS-8a69d52e-7_1 | EN300-91314_1_1 | −1.8 ± 0.2 | ||||||||
RUN9365 | MAT-POS-8a69d52e-7_1 | EN300-1590388_1_1 | −1.8 ± 0.2 | ||||||||
RUN1167 | MAT-POS-8a69d52e-7_1 | EN300-7353672_1_1 | −1.8 ± 0.3 | ||||||||
RUN7399 | MAT-POS-8a69d52e-7_1 | EN300-6489145_1_1 | −1.8 ± 0.3 | ||||||||
RUN11417 | MAT-POS-8a69d52e-7_1 | EN300-100467_3_1 | −1.8 ± 0.2 | ||||||||
RUN4209 | MAT-POS-8a69d52e-7_1 | EN300-364612_1_2 | −1.7 ± 0.3 | ||||||||
RUN14572 | MAT-POS-8a69d52e-7_1 | EN300-10334_3_1 | −1.7 ± 0.2 | ||||||||
RUN603 | MAT-POS-8a69d52e-7_1 | EN300-83527_1_1 | −1.7 ± 0.2 | ||||||||
RUN2080 | MAT-POS-8a69d52e-7_1 | EN300-6238494_2_2 | −1.7 ± 0.2 | ||||||||
RUN5645 | MAT-POS-8a69d52e-7_1 | EN300-18610_1_2 | −1.7 ± 0.2 | ||||||||
RUN6209 | MAT-POS-8a69d52e-7_1 | EN300-13890_1_2 | −1.7 ± 0.3 |