Transformations

Showing 301 through 400 of 100
RUN Atom map Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Bootstrapping Convergence
RUN1797 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-4_1 molecule 1.7 ± 0.5 work distributions bootstrapping convergence
RUN1562 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-94fddcec-5_1 molecule 1.7 ± 0.2 work distributions bootstrapping convergence
RUN1841 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-6_1 molecule 1.7 ± 0.6 work distributions bootstrapping convergence
RUN1870 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-12_1 molecule 1.7 ± 0.5 work distributions bootstrapping convergence
RUN1511 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7587a9ee-3_1 molecule 1.7 ± 0.2 work distributions bootstrapping convergence
RUN1738 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-5_2 molecule 1.7 ± 0.3 work distributions bootstrapping convergence
RUN1602 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-14_2 molecule 1.7 ± 0.3 work distributions bootstrapping convergence
RUN1546 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7587a9ee-1_1 molecule 1.8 ± 0.2 work distributions bootstrapping convergence
RUN1697 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-6_2 molecule 1.8 ± 0.4 work distributions bootstrapping convergence
RUN1889 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-1_2 molecule 1.8 ± 0.7 work distributions bootstrapping convergence
RUN1763 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-7_2 molecule 1.8 ± 0.3 work distributions bootstrapping convergence
RUN1568 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-afe0272e-1_1 molecule 1.8 ± 0.3 work distributions bootstrapping convergence
RUN1913 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-3_1 molecule 1.8 ± 0.8 work distributions bootstrapping convergence
RUN1744 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-2_2 molecule 1.8 ± 0.5 work distributions bootstrapping convergence
RUN1846 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-3_1 molecule 1.8 ± 0.7 work distributions bootstrapping convergence
RUN1535 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c7726e07-5_2 molecule 1.8 ± 0.2 work distributions bootstrapping convergence
RUN1475 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-e78d5f1a-1_2 molecule 1.8 ± 0.1 work distributions bootstrapping convergence
RUN1758 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-10_2 molecule 1.8 ± 0.5 work distributions bootstrapping convergence
RUN1502 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-94fddcec-4_1 molecule 1.8 ± 0.2 work distributions bootstrapping convergence
RUN1752 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-1_1 molecule 1.8 ± 0.4 work distributions bootstrapping convergence
RUN1557 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-ed2cfb03-2_1 molecule 1.9 ± 0.3 work distributions bootstrapping convergence
RUN1693 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-17_1 molecule 1.9 ± 0.4 work distributions bootstrapping convergence
RUN1497 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-2_1 molecule 1.9 ± 0.2 work distributions bootstrapping convergence
RUN1896 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-9_1 molecule 1.9 ± 0.5 work distributions bootstrapping convergence
RUN1538 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c7726e07-5_1 molecule 1.9 ± 0.3 work distributions bootstrapping convergence
RUN1628 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-576f7758-1_2 molecule 1.9 ± 0.3 work distributions bootstrapping convergence
RUN1585 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-4_4 molecule 1.9 ± 0.2 work distributions bootstrapping convergence
RUN1788 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-1_1 molecule 1.9 ± 0.4 work distributions bootstrapping convergence
RUN1505 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-51c67e7d-1_1 molecule 1.9 ± 0.2 work distributions bootstrapping convergence
RUN1464 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-159244ea-2_1 molecule 1.9 ± 0.1 work distributions bootstrapping convergence
RUN1945 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-3_2 molecule 1.9 ± 0.6 work distributions bootstrapping convergence
RUN1667 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-69786b79-3_1 molecule 1.9 ± 0.4 work distributions bootstrapping convergence
RUN1751 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-12_2 molecule 1.9 ± 0.4 work distributions bootstrapping convergence
RUN1725 VLA-UCB-50c39ae8-2_1 molecule MIK-ENA-5d9157e9-2_1 molecule 1.9 ± 0.5 work distributions bootstrapping convergence
RUN1700 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-9_2 molecule 2.0 ± 0.7 work distributions bootstrapping convergence
RUN1684 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-6_3 molecule 2.0 ± 0.3 work distributions bootstrapping convergence
RUN1921 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-5_2 molecule 2.0 ± 0.5 work distributions bootstrapping convergence
RUN1524 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-4_1 molecule 2.0 ± 0.3 work distributions bootstrapping convergence
RUN1556 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-2e8b2191-8_2 molecule 2.0 ± 0.2 work distributions bootstrapping convergence
RUN1530 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-4_2 molecule 2.0 ± 0.3 work distributions bootstrapping convergence
RUN1704 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-6_1 molecule 2.0 ± 0.4 work distributions bootstrapping convergence
RUN1509 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-51c67e7d-2_2 molecule 2.0 ± 0.1 work distributions bootstrapping convergence
RUN1777 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1d5ab790-1_1 molecule 2.0 ± 0.6 work distributions bootstrapping convergence
RUN1796 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-4_2 molecule 2.0 ± 0.5 work distributions bootstrapping convergence
RUN1822 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-8_2 molecule 2.0 ± 0.4 work distributions bootstrapping convergence
RUN1593 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-1f2dff76-1_2 molecule 2.0 ± 0.2 work distributions bootstrapping convergence
RUN1569 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1d5ab790-2_1 molecule 2.1 ± 0.3 work distributions bootstrapping convergence
RUN1947 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-4_1 molecule 2.1 ± 0.8 work distributions bootstrapping convergence
RUN1815 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-6_2 molecule 2.1 ± 0.5 work distributions bootstrapping convergence
RUN1508 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-51c67e7d-1_2 molecule 2.1 ± 0.1 work distributions bootstrapping convergence
RUN1829 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-4_2 molecule 2.1 ± 0.3 work distributions bootstrapping convergence
RUN1582 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-4_1 molecule 2.1 ± 0.3 work distributions bootstrapping convergence
RUN1791 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-1_2 molecule 2.1 ± 0.4 work distributions bootstrapping convergence
RUN1699 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-21_1 molecule 2.1 ± 0.3 work distributions bootstrapping convergence
RUN1564 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-b4d6b7fc-5_2 molecule 2.1 ± 0.3 work distributions bootstrapping convergence
RUN1677 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-10_2 molecule 2.1 ± 0.4 work distributions bootstrapping convergence
RUN1831 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-6_2 molecule 2.1 ± 0.7 work distributions bootstrapping convergence
RUN1510 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7587a9ee-3_2 molecule 2.2 ± 0.3 work distributions bootstrapping convergence
RUN1551 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-3_1 molecule 2.2 ± 0.3 work distributions bootstrapping convergence
RUN1600 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-7_2 molecule 2.2 ± 0.2 work distributions bootstrapping convergence
RUN1874 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-11_2 molecule 2.2 ± 0.6 work distributions bootstrapping convergence
RUN1573 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1d5ab790-2_2 molecule 2.2 ± 0.3 work distributions bootstrapping convergence
RUN1558 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-1_2 molecule 2.2 ± 0.3 work distributions bootstrapping convergence
RUN1864 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-15_2 molecule 2.2 ± 0.6 work distributions bootstrapping convergence
RUN1803 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-5_1 molecule 2.3 ± 0.5 work distributions bootstrapping convergence
RUN1715 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-13_1 molecule 2.3 ± 0.5 work distributions bootstrapping convergence
RUN1850 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-22_2 molecule 2.3 ± 0.7 work distributions bootstrapping convergence
RUN1466 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a6bab6fb-1_2 molecule 2.3 ± 0.1 work distributions bootstrapping convergence
RUN1589 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-b4dec3be-2_2 molecule 2.3 ± 0.3 work distributions bootstrapping convergence
RUN1670 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-19_1 molecule 2.3 ± 0.4 work distributions bootstrapping convergence
RUN1655 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-2_2 molecule 2.4 ± 0.4 work distributions bootstrapping convergence
RUN1586 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-96396902-1_2 molecule 2.4 ± 0.3 work distributions bootstrapping convergence
RUN1884 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-1_1 molecule 2.4 ± 0.5 work distributions bootstrapping convergence
RUN1590 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-b4dec3be-1_2 molecule 2.4 ± 0.3 work distributions bootstrapping convergence
RUN1828 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-8_2 molecule 2.4 ± 0.9 work distributions bootstrapping convergence
RUN1555 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-3_2 molecule 2.4 ± 0.2 work distributions bootstrapping convergence
RUN1770 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-14_2 molecule 2.4 ± 0.3 work distributions bootstrapping convergence
RUN1640 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-7_2 molecule 2.4 ± 0.3 work distributions bootstrapping convergence
RUN1843 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-6_2 molecule 2.4 ± 0.6 work distributions bootstrapping convergence
RUN1634 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-5_3 molecule 2.5 ± 0.3 work distributions bootstrapping convergence
RUN1789 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-1_1 molecule 2.5 ± 0.5 work distributions bootstrapping convergence
RUN1500 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-3_1 molecule 2.5 ± 0.2 work distributions bootstrapping convergence
RUN1799 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-1_3 molecule 2.5 ± 0.3 work distributions bootstrapping convergence
RUN1695 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-5_2 molecule 2.5 ± 0.5 work distributions bootstrapping convergence
RUN1918 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-3_4 molecule 2.5 ± 0.8 work distributions bootstrapping convergence
RUN1461 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-983b399a-2_2 molecule 2.5 ± 0.1 work distributions bootstrapping convergence
RUN1683 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-6_2 molecule 2.5 ± 0.3 work distributions bootstrapping convergence
RUN1760 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-5_1 molecule 2.6 ± 0.6 work distributions bootstrapping convergence
RUN1473 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-f3cfbbb5-1_2 molecule 2.6 ± 0.1 work distributions bootstrapping convergence
RUN1845 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-13_1 molecule 2.6 ± 0.6 work distributions bootstrapping convergence
RUN1936 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-5_1 molecule 2.6 ± 0.8 work distributions bootstrapping convergence
RUN1836 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-6_1 molecule 2.6 ± 0.4 work distributions bootstrapping convergence
RUN1492 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-1_1 molecule 2.7 ± 0.2 work distributions bootstrapping convergence
RUN1661 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-3_2 molecule 2.7 ± 0.4 work distributions bootstrapping convergence
RUN1476 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-e78d5f1a-1_1 molecule 2.7 ± 0.1 work distributions bootstrapping convergence
RUN1463 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-159244ea-2_2 molecule 2.8 ± 0.1 work distributions bootstrapping convergence
RUN1682 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-19_3 molecule 3 ± 1 work distributions bootstrapping convergence
RUN1809 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-eaf50f21-1_1 molecule 2.8 ± 0.4 work distributions bootstrapping convergence
RUN1685 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-3_2 molecule 2.8 ± 0.3 work distributions bootstrapping convergence
RUN1646 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-7_2 molecule 2.8 ± 0.3 work distributions bootstrapping convergence
Last updated 2022-01-08T06:54:59.612175+00:00
Generated by fah-xchem version pre-sprint-5+122.gaf80f5c