Transformations

Showing 1 through 100 of 100
RUN Atom map Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Bootstrapping Convergence
RUN1905 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-1_2 molecule −5.7 ± 0.6 work distributions bootstrapping convergence
RUN1892 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-3_1 molecule −4.7 ± 0.5 work distributions bootstrapping convergence
RUN1927 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-3_2 molecule −3.7 ± 0.6 work distributions bootstrapping convergence
RUN1817 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-5_1 molecule −3.4 ± 0.4 work distributions bootstrapping convergence
RUN1907 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8484f2d3-2_2 molecule −3.1 ± 0.6 work distributions bootstrapping convergence
RUN1805 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7e491f08-2_1 molecule −3.0 ± 0.1 work distributions bootstrapping convergence
RUN1934 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-5_2 molecule −3.0 ± 0.7 work distributions bootstrapping convergence
RUN1755 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-2_1 molecule −2.9 ± 0.6 work distributions bootstrapping convergence
RUN1739 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-5_1 molecule −2.8 ± 0.1 work distributions bootstrapping convergence
RUN1801 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-8_1 molecule −2.8 ± 0.2 work distributions bootstrapping convergence
RUN1915 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-4_1 molecule −2.7 ± 0.6 work distributions bootstrapping convergence
RUN1759 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-6_1 molecule −2.7 ± 0.4 work distributions bootstrapping convergence
RUN1787 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-7_1 molecule −2.7 ± 0.2 work distributions bootstrapping convergence
RUN1714 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-10_2 molecule −2.4 ± 0.7 work distributions bootstrapping convergence
RUN1937 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-d1147590-1_2 molecule −2.4 ± 0.6 work distributions bootstrapping convergence
RUN1946 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-3_1 molecule −2.3 ± 0.3 work distributions bootstrapping convergence
RUN1938 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_7 molecule −2.2 ± 0.6 work distributions bootstrapping convergence
RUN1730 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-2_1 molecule −2.1 ± 0.2 work distributions bootstrapping convergence
RUN1902 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8484f2d3-1_2 molecule −2.1 ± 0.8 work distributions bootstrapping convergence
RUN1605 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-1_1 molecule −2.0 ± 0.1 work distributions bootstrapping convergence
RUN1731 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-4_1 molecule −2.0 ± 0.2 work distributions bootstrapping convergence
RUN1920 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-5_1 molecule −1.9 ± 0.3 work distributions bootstrapping convergence
RUN1883 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-8_1 molecule −1.9 ± 0.6 work distributions bootstrapping convergence
RUN1674 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-2_1 molecule −1.8 ± 0.1 work distributions bootstrapping convergence
RUN1651 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-1_1 molecule −1.8 ± 0.2 work distributions bootstrapping convergence
RUN1672 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-3_1 molecule −1.8 ± 0.2 work distributions bootstrapping convergence
RUN1914 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-4_2 molecule −1.8 ± 0.6 work distributions bootstrapping convergence
RUN1784 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-3_1 molecule −1.8 ± 0.5 work distributions bootstrapping convergence
RUN1854 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-3_2 molecule −1.8 ± 0.5 work distributions bootstrapping convergence
RUN1737 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-5_1 molecule −1.8 ± 0.2 work distributions bootstrapping convergence
RUN1780 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-6_1 molecule −1.6 ± 0.2 work distributions bootstrapping convergence
RUN1814 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-1_1 molecule −1.6 ± 0.4 work distributions bootstrapping convergence
RUN1827 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-2_3 molecule −1.6 ± 0.8 work distributions bootstrapping convergence
RUN1627 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-2_1 molecule −1.6 ± 0.1 work distributions bootstrapping convergence
RUN1620 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-7_1 molecule −1.6 ± 0.1 work distributions bootstrapping convergence
RUN1903 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-2_1 molecule −1.6 ± 0.4 work distributions bootstrapping convergence
RUN1911 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-2_3 molecule −1.5 ± 0.6 work distributions bootstrapping convergence
RUN1910 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-2_4 molecule −1.4 ± 0.7 work distributions bootstrapping convergence
RUN1877 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-4_1 molecule −1.4 ± 0.6 work distributions bootstrapping convergence
RUN1491 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-0f7b7cd9-9_1 molecule −1.40 ± 0.09 work distributions bootstrapping convergence
RUN1771 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-1_2 molecule −1.3 ± 0.4 work distributions bootstrapping convergence
RUN1900 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-1_1 molecule −1.3 ± 0.3 work distributions bootstrapping convergence
RUN1943 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-5_1 molecule −1.3 ± 0.8 work distributions bootstrapping convergence
RUN1639 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-2_1 molecule −1.3 ± 0.3 work distributions bootstrapping convergence
RUN1825 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-2_2 molecule −1.3 ± 0.4 work distributions bootstrapping convergence
RUN1666 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-576f7758-2_1 molecule −1.3 ± 0.2 work distributions bootstrapping convergence
RUN1922 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-2_1 molecule −1.3 ± 0.3 work distributions bootstrapping convergence
RUN1810 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-4_2 molecule −1.2 ± 0.4 work distributions bootstrapping convergence
RUN1924 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_5 molecule −1.2 ± 0.7 work distributions bootstrapping convergence
RUN1793 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-1_2 molecule −1.2 ± 0.6 work distributions bootstrapping convergence
RUN1890 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-7_1 molecule −1.2 ± 0.5 work distributions bootstrapping convergence
RUN1839 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-4_1 molecule −1.2 ± 0.2 work distributions bootstrapping convergence
RUN1775 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-5_2 molecule −1.1 ± 0.8 work distributions bootstrapping convergence
RUN1925 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_1 molecule −1.1 ± 0.6 work distributions bootstrapping convergence
RUN1635 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-34f3ed0c-14_1 molecule −1.1 ± 0.2 work distributions bootstrapping convergence
RUN1642 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-6_1 molecule −1.1 ± 0.2 work distributions bootstrapping convergence
RUN1641 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8c3e556a-2_1 molecule −1.1 ± 0.2 work distributions bootstrapping convergence
RUN1897 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-9_2 molecule −1.1 ± 0.6 work distributions bootstrapping convergence
RUN1786 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-3_2 molecule −1.0 ± 0.3 work distributions bootstrapping convergence
RUN1566 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-14142a25-10_1 molecule −1.0 ± 0.2 work distributions bootstrapping convergence
RUN1944 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-4_1 molecule −1.0 ± 0.5 work distributions bootstrapping convergence
RUN1597 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-2_1 molecule −1.0 ± 0.2 work distributions bootstrapping convergence
RUN1781 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-1_1 molecule −1.0 ± 0.3 work distributions bootstrapping convergence
RUN1571 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-1_1 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN1594 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-1_1 molecule −1.0 ± 0.2 work distributions bootstrapping convergence
RUN1886 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-5_1 molecule −1.0 ± 0.3 work distributions bootstrapping convergence
RUN1601 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-4_1 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN1552 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-8_1 molecule −1.0 ± 0.2 work distributions bootstrapping convergence
RUN1671 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-976a33d5-1_1 molecule −1.0 ± 0.2 work distributions bootstrapping convergence
RUN1894 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-1_1 molecule −1.0 ± 0.4 work distributions bootstrapping convergence
RUN1800 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-1_2 molecule −1.0 ± 0.3 work distributions bootstrapping convergence
RUN1489 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-0f7b7cd9-8_1 molecule −0.9 ± 0.1 work distributions bootstrapping convergence
RUN1779 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-22_1 molecule −0.9 ± 0.4 work distributions bootstrapping convergence
RUN1519 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-9_1 molecule −0.9 ± 0.2 work distributions bootstrapping convergence
RUN1631 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fd8ed875-5_1 molecule −0.9 ± 0.1 work distributions bootstrapping convergence
RUN1823 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-2_1 molecule −0.9 ± 0.3 work distributions bootstrapping convergence
RUN1581 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-9931618f-1_1 molecule −0.8 ± 0.2 work distributions bootstrapping convergence
RUN1587 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-96396902-1_1 molecule −0.8 ± 0.2 work distributions bootstrapping convergence
RUN1834 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7e491f08-1_1 molecule −0.8 ± 0.7 work distributions bootstrapping convergence
RUN1860 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-2_2 molecule −0.8 ± 0.6 work distributions bootstrapping convergence
RUN1603 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-2_1 molecule −0.8 ± 0.2 work distributions bootstrapping convergence
RUN1606 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-8_1 molecule −0.8 ± 0.1 work distributions bootstrapping convergence
RUN1792 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-6_1 molecule −0.8 ± 0.2 work distributions bootstrapping convergence
RUN1663 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-17_4 molecule −0.7 ± 0.5 work distributions bootstrapping convergence
RUN1488 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-34f3ed0c-11_1 molecule −0.73 ± 0.07 work distributions bootstrapping convergence
RUN1470 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-983b399a-1_1 molecule −0.71 ± 0.09 work distributions bootstrapping convergence
RUN1747 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fd8ed875-6_1 molecule −0.7 ± 0.2 work distributions bootstrapping convergence
RUN1515 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-3_1 molecule −0.7 ± 0.3 work distributions bootstrapping convergence
RUN1490 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-29506327-1_1 molecule −0.65 ± 0.08 work distributions bootstrapping convergence
RUN1871 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-2_1 molecule −0.6 ± 0.4 work distributions bootstrapping convergence
RUN1471 VLA-UCB-50c39ae8-2_1 molecule BEN-BAS-c2bc0d80-3_1 molecule −0.64 ± 0.09 work distributions bootstrapping convergence
RUN1483 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-cf7facf1-1_1 molecule −0.62 ± 0.07 work distributions bootstrapping convergence
RUN1906 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-8484f2d3-1_1 molecule −0.6 ± 0.6 work distributions bootstrapping convergence
RUN1720 VLA-UCB-50c39ae8-2_1 molecule MIK-ENA-5d9157e9-1_2 molecule −0.6 ± 0.6 work distributions bootstrapping convergence
RUN1619 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-20_1 molecule −0.6 ± 0.6 work distributions bootstrapping convergence
RUN1629 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1d5ab790-3_1 molecule −0.6 ± 0.2 work distributions bootstrapping convergence
RUN1740 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-7_1 molecule −0.6 ± 0.2 work distributions bootstrapping convergence
RUN1503 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-3a43cd95-1_1 molecule −0.57 ± 0.09 work distributions bootstrapping convergence
RUN1467 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-477dc5b7-4_1 molecule −0.6 ± 0.1 work distributions bootstrapping convergence
RUN1608 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-3_1 molecule −0.6 ± 0.2 work distributions bootstrapping convergence
Last updated 2022-01-08T06:54:59.612175+00:00
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