Transformations

Showing 1 through 100 of 100
RUN Atom map Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Bootstrapping Convergence
RUN999 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-2_1 molecule −4.8 ± 0.7 work distributions bootstrapping convergence
RUN995 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8484f2d3-1_1 molecule −4.2 ± 0.6 work distributions bootstrapping convergence
RUN968 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-61877630-9_1 molecule −3.5 ± 0.4 work distributions bootstrapping convergence
RUN997 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-3_1 molecule −3.5 ± 0.5 work distributions bootstrapping convergence
RUN985 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-7_1 molecule −3.5 ± 0.4 work distributions bootstrapping convergence
RUN918 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-7_1 molecule −3.3 ± 0.1 work distributions bootstrapping convergence
RUN885 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-6_1 molecule −3.2 ± 0.4 work distributions bootstrapping convergence
RUN934 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-5_1 molecule −3.1 ± 0.3 work distributions bootstrapping convergence
RUN990 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-1_1 molecule −2.9 ± 0.6 work distributions bootstrapping convergence
RUN983 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7d88f880-3_2 molecule −2.9 ± 0.6 work distributions bootstrapping convergence
RUN836 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-3_1 molecule −2.9 ± 0.1 work distributions bootstrapping convergence
RUN977 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-8_1 molecule −2.8 ± 0.5 work distributions bootstrapping convergence
RUN802 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-2_1 molecule −2.8 ± 0.1 work distributions bootstrapping convergence
RUN973 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-11_1 molecule −2.7 ± 0.4 work distributions bootstrapping convergence
RUN888 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-2_1 molecule −2.6 ± 0.4 work distributions bootstrapping convergence
RUN887 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-5_1 molecule −2.5 ± 0.2 work distributions bootstrapping convergence
RUN707 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-0f7b7cd9-9_1 molecule −2.50 ± 0.07 work distributions bootstrapping convergence
RUN910 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-8_1 molecule −2.5 ± 0.2 work distributions bootstrapping convergence
RUN929 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-1_1 molecule −2.4 ± 0.3 work distributions bootstrapping convergence
RUN992 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-10_1 molecule −2.4 ± 0.5 work distributions bootstrapping convergence
RUN935 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-6_1 molecule −2.2 ± 0.3 work distributions bootstrapping convergence
RUN806 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-6af7266d-3_1 molecule −2.2 ± 0.1 work distributions bootstrapping convergence
RUN913 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-1_1 molecule −2.2 ± 0.4 work distributions bootstrapping convergence
RUN994 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-4_1 molecule −2.2 ± 0.7 work distributions bootstrapping convergence
RUN820 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-7_1 molecule −2.1 ± 0.2 work distributions bootstrapping convergence
RUN984 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-5_1 molecule −2.1 ± 0.3 work distributions bootstrapping convergence
RUN853 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-6_2 molecule −2.1 ± 0.2 work distributions bootstrapping convergence
RUN805 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-6af7266d-1_1 molecule −2.06 ± 0.10 work distributions bootstrapping convergence
RUN884 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-5_1 molecule −2.0 ± 0.2 work distributions bootstrapping convergence
RUN987 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-19_1 molecule −2.0 ± 0.4 work distributions bootstrapping convergence
RUN947 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7e491f08-1_1 molecule −2.0 ± 0.5 work distributions bootstrapping convergence
RUN1000 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_2 molecule −2.0 ± 0.7 work distributions bootstrapping convergence
RUN978 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-4_1 molecule −2.0 ± 0.3 work distributions bootstrapping convergence
RUN986 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-9_1 molecule −1.9 ± 0.7 work distributions bootstrapping convergence
RUN979 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7d88f880-3_1 molecule −1.9 ± 0.6 work distributions bootstrapping convergence
RUN905 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-5_1 molecule −1.9 ± 1.0 work distributions bootstrapping convergence
RUN927 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-61877630-3_1 molecule −1.9 ± 0.2 work distributions bootstrapping convergence
RUN790 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-7_1 molecule −1.89 ± 0.10 work distributions bootstrapping convergence
RUN828 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-5_2 molecule −1.9 ± 0.2 work distributions bootstrapping convergence
RUN966 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-2_1 molecule −1.9 ± 0.4 work distributions bootstrapping convergence
RUN682 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-159244ea-1_1 molecule −1.80 ± 0.05 work distributions bootstrapping convergence
RUN1012 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-2_1 molecule −1.8 ± 0.3 work distributions bootstrapping convergence
RUN691 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-983b399a-1_1 molecule −1.74 ± 0.05 work distributions bootstrapping convergence
RUN930 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-4_1 molecule −1.7 ± 0.2 work distributions bootstrapping convergence
RUN1014 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-5_1 molecule −1.7 ± 0.5 work distributions bootstrapping convergence
RUN695 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-477dc5b7-4_1 molecule −1.67 ± 0.05 work distributions bootstrapping convergence
RUN1009 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-5_1 molecule −1.7 ± 0.5 work distributions bootstrapping convergence
RUN781 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-1_1 molecule −1.65 ± 0.09 work distributions bootstrapping convergence
RUN976 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-12_1 molecule −1.6 ± 0.4 work distributions bootstrapping convergence
RUN716 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-0f7b7cd9-8_1 molecule −1.60 ± 0.08 work distributions bootstrapping convergence
RUN697 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-29506327-1_1 molecule −1.60 ± 0.05 work distributions bootstrapping convergence
RUN734 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-14142a25-10_1 molecule −1.6 ± 0.1 work distributions bootstrapping convergence
RUN748 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-9931618f-1_1 molecule −1.6 ± 0.1 work distributions bootstrapping convergence
RUN768 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-2_1 molecule −1.6 ± 0.1 work distributions bootstrapping convergence
RUN991 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8484f2d3-2_1 molecule −1.6 ± 0.6 work distributions bootstrapping convergence
RUN712 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-9_1 molecule −1.57 ± 0.09 work distributions bootstrapping convergence
RUN907 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7e491f08-2_1 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN730 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-8_1 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN1015 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-1_1 molecule −1.5 ± 0.4 work distributions bootstrapping convergence
RUN840 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-6af7266d-2_1 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN993 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-5_1 molecule −1.5 ± 0.2 work distributions bootstrapping convergence
RUN1002 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-3_1 molecule −1.5 ± 0.6 work distributions bootstrapping convergence
RUN753 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fd8ed875-3_1 molecule −1.47 ± 0.09 work distributions bootstrapping convergence
RUN1006 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-1_1 molecule −1.5 ± 0.6 work distributions bootstrapping convergence
RUN699 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-cf7facf1-1_1 molecule −1.46 ± 0.05 work distributions bootstrapping convergence
RUN732 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-14142a25-1_1 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN967 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-3_1 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN1013 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-5_1 molecule −1.5 ± 0.5 work distributions bootstrapping convergence
RUN795 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8c3e556a-1_1 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN788 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-20_1 molecule −1.4 ± 0.7 work distributions bootstrapping convergence
RUN786 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-18_1 molecule −1.4 ± 0.2 work distributions bootstrapping convergence
RUN988 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-1_1 molecule −1.4 ± 0.3 work distributions bootstrapping convergence
RUN689 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-34f3ed0c-11_1 molecule −1.39 ± 0.05 work distributions bootstrapping convergence
RUN773 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-3_1 molecule −1.4 ± 0.1 work distributions bootstrapping convergence
RUN1005 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-4_1 molecule −1.4 ± 0.3 work distributions bootstrapping convergence
RUN862 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-10_1 molecule −1.4 ± 0.4 work distributions bootstrapping convergence
RUN866 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-3_1 molecule −1.4 ± 0.2 work distributions bootstrapping convergence
RUN881 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-4_1 molecule −1.4 ± 0.2 work distributions bootstrapping convergence
RUN692 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-6be260fc-5_1 molecule −1.34 ± 0.09 work distributions bootstrapping convergence
RUN752 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-9931618f-2_1 molecule −1.3 ± 0.1 work distributions bootstrapping convergence
RUN890 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-2_1 molecule −1.3 ± 0.3 work distributions bootstrapping convergence
RUN785 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-6_1 molecule −1.3 ± 0.1 work distributions bootstrapping convergence
RUN845 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-6af7266d-4_1 molecule −1.2 ± 0.1 work distributions bootstrapping convergence
RUN917 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-61877630-7_1 molecule −1.2 ± 0.4 work distributions bootstrapping convergence
RUN847 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-6_1 molecule −1.2 ± 0.4 work distributions bootstrapping convergence
RUN784 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-4_2 molecule −1.1 ± 0.2 work distributions bootstrapping convergence
RUN950 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-2_2 molecule −1.1 ± 0.6 work distributions bootstrapping convergence
RUN744 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-1_1 molecule −1.1 ± 0.1 work distributions bootstrapping convergence
RUN904 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7d88f880-1_2 molecule −1.1 ± 0.2 work distributions bootstrapping convergence
RUN953 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-3_1 molecule −1.1 ± 0.3 work distributions bootstrapping convergence
RUN793 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8c3e556a-2_1 molecule −1.1 ± 0.1 work distributions bootstrapping convergence
RUN842 VLA-UCB-50c39ae8-2_1 molecule 12_-111-3e02a1cd-1_1 molecule −1.1 ± 0.1 work distributions bootstrapping convergence
RUN839 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-d4864bdc-4_1 molecule −1.0 ± 0.3 work distributions bootstrapping convergence
RUN833 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-e48723dc-1_1 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN816 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-976a33d5-1_1 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN871 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-7_1 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN824 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-2_1 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN1008 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-4_1 molecule −1.0 ± 0.5 work distributions bootstrapping convergence
RUN876 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-6_1 molecule −0.9 ± 0.3 work distributions bootstrapping convergence
RUN855 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-13_1 molecule −0.9 ± 0.3 work distributions bootstrapping convergence
Last updated 2022-01-15T00:44:38.149510+00:00
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