Transformations

Showing 901 through 1000 of 100
RUN Atom map Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Bootstrapping Convergence
RUN458 MAT-POS-c7726e07-5_1 molecule EDJ-MED-ede5c6cb-2_1 molecule 1.4 ± 0.4 work distributions bootstrapping convergence
RUN35 MAT-POS-c7726e07-5_1 molecule EDJ-MED-7587a9ee-3_1 molecule 1.4 ± 0.7 work distributions bootstrapping convergence
RUN417 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-6_1 molecule 1.4 ± 0.7 work distributions bootstrapping convergence
RUN158 MAT-POS-c7726e07-5_1 molecule ALP-POS-c3a90b22-6_1 molecule 1.4 ± 0.4 work distributions bootstrapping convergence
RUN881 MAT-POS-c7726e07-5_1 molecule MIK-ENA-e143773d-1_1 molecule 1.5 ± 0.9 work distributions bootstrapping convergence
RUN762 MAT-POS-c7726e07-5_1 molecule LUO-POS-e1dab717-9_1 molecule 1.5 ± 0.7 work distributions bootstrapping convergence
RUN20 MAT-POS-c7726e07-5_1 molecule EDJ-MED-f9b78f78-4_1 molecule 1.5 ± 0.4 work distributions bootstrapping convergence
RUN1048 MAT-POS-c7726e07-5_1 molecule LUO-POS-d1147590-1_1 molecule 1.5 ± 1.0 work distributions bootstrapping convergence
RUN867 MAT-POS-c7726e07-5_1 molecule EDJ-MED-4138fde9-3_1 molecule 1.6 ± 0.5 work distributions bootstrapping convergence
RUN1050 MAT-POS-c7726e07-5_1 molecule MAT-POS-1a788f51-4_1 molecule 1.7 ± 0.8 work distributions bootstrapping convergence
RUN285 MAT-POS-c7726e07-5_1 molecule EDJ-MED-3707c4bc-1_1 molecule 1.7 ± 0.9 work distributions bootstrapping convergence
RUN308 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-19_1 molecule 2 ± 1 work distributions bootstrapping convergence
RUN569 MAT-POS-c7726e07-5_1 molecule MAT-POS-853c0ffa-14_1 molecule 1.7 ± 0.9 work distributions bootstrapping convergence
RUN1076 MAT-POS-c7726e07-5_1 molecule EDJ-MED-dfa1d800-4_1 molecule 1.8 ± 0.5 work distributions bootstrapping convergence
RUN464 MAT-POS-c7726e07-5_1 molecule PET-UNK-94036022-9_1 molecule 1.8 ± 0.8 work distributions bootstrapping convergence
RUN419 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-9_1 molecule 1.8 ± 0.9 work distributions bootstrapping convergence
RUN219 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-7_1 molecule 1.8 ± 0.3 work distributions bootstrapping convergence
RUN14 MAT-POS-c7726e07-5_1 molecule JOH-MSK-1f2dff76-3_1 molecule 1.8 ± 0.4 work distributions bootstrapping convergence
RUN814 MAT-POS-c7726e07-5_1 molecule MIK-ENA-17e27e9c-1_2 molecule 1.8 ± 0.8 work distributions bootstrapping convergence
RUN884 MAT-POS-c7726e07-5_1 molecule MIK-ENA-edcfce18-1_1 molecule 1.9 ± 0.6 work distributions bootstrapping convergence
RUN1042 MAT-POS-c7726e07-5_1 molecule LUO-POS-d1147590-1_1 molecule 1.9 ± 0.9 work distributions bootstrapping convergence
RUN854 MAT-POS-c7726e07-5_1 molecule EDJ-MED-5cd3920d-2_1 molecule 1.9 ± 0.8 work distributions bootstrapping convergence
RUN824 MAT-POS-c7726e07-5_1 molecule MIK-ENA-2c0ad173-1_2 molecule 1.9 ± 0.7 work distributions bootstrapping convergence
RUN1031 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_3 molecule 2.0 ± 0.9 work distributions bootstrapping convergence
RUN1045 MAT-POS-c7726e07-5_1 molecule EDJ-MED-468565e0-1_1 molecule 2.1 ± 0.8 work distributions bootstrapping convergence
RUN334 MAT-POS-c7726e07-5_1 molecule PET-UNK-94036022-10_1 molecule 2.1 ± 0.8 work distributions bootstrapping convergence
RUN572 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-5_1 molecule 2.2 ± 0.9 work distributions bootstrapping convergence
RUN465 MAT-POS-c7726e07-5_1 molecule PET-UNK-94036022-12_1 molecule 2.2 ± 0.9 work distributions bootstrapping convergence
RUN865 MAT-POS-c7726e07-5_1 molecule EDJ-MED-4138fde9-3_1 molecule 2.2 ± 0.6 work distributions bootstrapping convergence
RUN221 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-7_1 molecule 2.3 ± 0.3 work distributions bootstrapping convergence
RUN813 MAT-POS-c7726e07-5_1 molecule MIK-ENA-17e27e9c-1_1 molecule 2.3 ± 0.8 work distributions bootstrapping convergence
RUN852 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-3_1 molecule 2.4 ± 0.9 work distributions bootstrapping convergence
RUN1061 MAT-POS-c7726e07-5_1 molecule MIC-UNK-c85ea37c-3_1 molecule 2.4 ± 0.9 work distributions bootstrapping convergence
RUN834 MAT-POS-c7726e07-5_1 molecule MAT-POS-853c0ffa-22_1 molecule 2.4 ± 0.8 work distributions bootstrapping convergence
RUN161 MAT-POS-c7726e07-5_1 molecule EDJ-MED-40e596c8-1_1 molecule 2.5 ± 0.8 work distributions bootstrapping convergence
RUN24 MAT-POS-c7726e07-5_1 molecule EDJ-MED-f9b78f78-4_1 molecule 2.5 ± 0.4 work distributions bootstrapping convergence
RUN415 MAT-POS-c7726e07-5_1 molecule MAT-POS-853c0ffa-21_1 molecule 2.5 ± 0.8 work distributions bootstrapping convergence
RUN184 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-18_1 molecule 2.5 ± 0.9 work distributions bootstrapping convergence
RUN371 MAT-POS-c7726e07-5_1 molecule VLA-UNK-5d8210f0-5_2 molecule 2.5 ± 0.7 work distributions bootstrapping convergence
RUN1033 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_4 molecule 3 ± 1 work distributions bootstrapping convergence
RUN1016 MAT-POS-c7726e07-5_1 molecule EDJ-MED-ee81482e-3_1 molecule 3 ± 1 work distributions bootstrapping convergence
RUN286 MAT-POS-c7726e07-5_1 molecule EDJ-MED-3707c4bc-1_1 molecule 2.6 ± 0.9 work distributions bootstrapping convergence
RUN1067 MAT-POS-c7726e07-5_1 molecule MIC-UNK-c85ea37c-3_1 molecule 2.6 ± 0.8 work distributions bootstrapping convergence
RUN767 MAT-POS-c7726e07-5_1 molecule LUO-POS-e1dab717-16_1 molecule 2.6 ± 1.0 work distributions bootstrapping convergence
RUN1038 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_4 molecule 2.6 ± 0.7 work distributions bootstrapping convergence
RUN220 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-7_1 molecule 2.6 ± 0.3 work distributions bootstrapping convergence
RUN439 MAT-POS-c7726e07-5_1 molecule EDJ-MED-976a33d5-3_1 molecule 2.7 ± 0.9 work distributions bootstrapping convergence
RUN305 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-17_1 molecule 2.7 ± 0.8 work distributions bootstrapping convergence
RUN1029 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_1 molecule 2.7 ± 0.9 work distributions bootstrapping convergence
RUN885 MAT-POS-c7726e07-5_1 molecule MIK-ENA-edcfce18-1_2 molecule 2.7 ± 0.7 work distributions bootstrapping convergence
RUN1064 MAT-POS-c7726e07-5_1 molecule MIC-UNK-c85ea37c-3_2 molecule 2.7 ± 0.9 work distributions bootstrapping convergence
RUN1013 MAT-POS-c7726e07-5_1 molecule EDJ-MED-ee81482e-3_1 molecule 2.7 ± 1.0 work distributions bootstrapping convergence
RUN1086 MAT-POS-c7726e07-5_1 molecule MIC-UNK-c85ea37c-2_2 molecule 2.8 ± 0.9 work distributions bootstrapping convergence
RUN65 MAT-POS-c7726e07-5_1 molecule LUO-POS-ed2cfb03-2_1 molecule 2.9 ± 0.9 work distributions bootstrapping convergence
RUN594 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-1_1 molecule 2.9 ± 0.9 work distributions bootstrapping convergence
RUN842 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-11_1 molecule 2.9 ± 0.9 work distributions bootstrapping convergence
RUN815 MAT-POS-c7726e07-5_1 molecule MIK-ENA-17e27e9c-1_1 molecule 3.0 ± 0.6 work distributions bootstrapping convergence
RUN374 MAT-POS-c7726e07-5_1 molecule EDJ-MED-3707c4bc-2_1 molecule 3.0 ± 0.7 work distributions bootstrapping convergence
RUN424 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-10_1 molecule 3.0 ± 0.8 work distributions bootstrapping convergence
RUN890 MAT-POS-c7726e07-5_1 molecule MIK-ENA-0547b12c-1_2 molecule 3.1 ± 0.6 work distributions bootstrapping convergence
RUN886 MAT-POS-c7726e07-5_1 molecule MIK-ENA-0547b12c-1_2 molecule 3.1 ± 1.0 work distributions bootstrapping convergence
RUN891 MAT-POS-c7726e07-5_1 molecule MIC-UNK-257d841f-1_1 molecule 3.1 ± 0.8 work distributions bootstrapping convergence
RUN421 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-13_1 molecule 3.1 ± 0.9 work distributions bootstrapping convergence
RUN1011 MAT-POS-c7726e07-5_1 molecule EDJ-MED-ee81482e-3_2 molecule 3.2 ± 1.0 work distributions bootstrapping convergence
RUN819 MAT-POS-c7726e07-5_1 molecule MIK-ENA-623fe2a6-1_2 molecule 3.2 ± 0.9 work distributions bootstrapping convergence
RUN378 MAT-POS-c7726e07-5_1 molecule EDJ-MED-3707c4bc-2_1 molecule 3.2 ± 0.7 work distributions bootstrapping convergence
RUN987 MAT-POS-c7726e07-5_1 molecule EDJ-MED-ee81482e-4_1 molecule 3 ± 1 work distributions bootstrapping convergence
RUN739 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-8_1 molecule 3.3 ± 0.7 work distributions bootstrapping convergence
RUN879 MAT-POS-c7726e07-5_1 molecule MIK-ENA-be04d1d4-1_2 molecule 3.4 ± 0.9 work distributions bootstrapping convergence
RUN991 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-2_1 molecule 3.5 ± 0.9 work distributions bootstrapping convergence
RUN737 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-8_1 molecule 3.5 ± 0.9 work distributions bootstrapping convergence
RUN67 MAT-POS-c7726e07-5_1 molecule LUO-POS-ed2cfb03-2_1 molecule 3.5 ± 0.8 work distributions bootstrapping convergence
RUN1032 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_2 molecule 3.6 ± 1.0 work distributions bootstrapping convergence
RUN877 MAT-POS-c7726e07-5_1 molecule MIK-ENA-be04d1d4-1_2 molecule 3.6 ± 0.9 work distributions bootstrapping convergence
RUN822 MAT-POS-c7726e07-5_1 molecule MIK-ENA-2c0ad173-1_1 molecule 3.6 ± 0.8 work distributions bootstrapping convergence
RUN595 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-1_2 molecule 3.6 ± 0.6 work distributions bootstrapping convergence
RUN1041 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-3_1 molecule 4 ± 1 work distributions bootstrapping convergence
RUN1037 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_2 molecule 4 ± 1 work distributions bootstrapping convergence
RUN593 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-1_1 molecule 3.7 ± 0.7 work distributions bootstrapping convergence
RUN1007 MAT-POS-c7726e07-5_1 molecule MIC-UNK-c85ea37c-1_2 molecule 4 ± 1 work distributions bootstrapping convergence
RUN1034 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-1_2 molecule 3.9 ± 0.8 work distributions bootstrapping convergence
RUN428 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-21_1 molecule 3.9 ± 0.9 work distributions bootstrapping convergence
RUN983 MAT-POS-c7726e07-5_1 molecule MIK-ENA-8063e9dc-1_1 molecule 3.9 ± 0.9 work distributions bootstrapping convergence
RUN596 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-1_2 molecule 3.9 ± 0.8 work distributions bootstrapping convergence
RUN771 MAT-POS-c7726e07-5_1 molecule EDJ-MED-4138fde9-7_1 molecule 3.9 ± 0.9 work distributions bootstrapping convergence
RUN996 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-4_1 molecule 4.1 ± 0.9 work distributions bootstrapping convergence
RUN575 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-22_1 molecule 4.1 ± 0.8 work distributions bootstrapping convergence
RUN1069 MAT-POS-c7726e07-5_1 molecule MIC-UNK-c85ea37c-3_1 molecule 4.2 ± 0.9 work distributions bootstrapping convergence
RUN754 MAT-POS-c7726e07-5_1 molecule PET-UNK-94036022-6_1 molecule 4 ± 1 work distributions bootstrapping convergence
RUN418 MAT-POS-c7726e07-5_1 molecule ALP-POS-ecbed2ba-9_1 molecule 4 ± 1 work distributions bootstrapping convergence
RUN1057 MAT-POS-c7726e07-5_1 molecule EDJ-MED-468565e0-2_1 molecule 4.5 ± 0.7 work distributions bootstrapping convergence
RUN816 MAT-POS-c7726e07-5_1 molecule MIK-ENA-17e27e9c-1_2 molecule 4.5 ± 0.8 work distributions bootstrapping convergence
RUN1058 MAT-POS-c7726e07-5_1 molecule EDJ-MED-468565e0-2_1 molecule 4.6 ± 0.8 work distributions bootstrapping convergence
RUN769 MAT-POS-c7726e07-5_1 molecule LUO-POS-f7b1afe6-2_1 molecule 4.6 ± 1.0 work distributions bootstrapping convergence
RUN1044 MAT-POS-c7726e07-5_1 molecule LUO-POS-d1147590-1_1 molecule 5 ± 1 work distributions bootstrapping convergence
RUN738 MAT-POS-c7726e07-5_1 molecule MAT-POS-50a80394-2_1 molecule 4.7 ± 0.5 work distributions bootstrapping convergence
RUN770 MAT-POS-c7726e07-5_1 molecule LUO-POS-f7b1afe6-2_1 molecule 5 ± 1 work distributions bootstrapping convergence
RUN821 MAT-POS-c7726e07-5_1 molecule MIK-ENA-623fe2a6-1_2 molecule 5.0 ± 0.9 work distributions bootstrapping convergence
RUN1017 MAT-POS-c7726e07-5_1 molecule EDJ-MED-ee81482e-3_1 molecule 5 ± 1 work distributions bootstrapping convergence
RUN997 MAT-POS-c7726e07-5_1 molecule MAT-POS-40ad851a-2_2 molecule 5 ± 1 work distributions bootstrapping convergence
Last updated 2022-02-18T17:39:04.510229+00:00
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