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Application

Discovery Studio 0.791273465246068 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06747802569303583 Amorphous Cell 0.29263015551048005 Blends 0.0021636240703177823 CASTEP 0.38228532792427317 CDOCKER 0.1436105476673428 CHARMm 0.2279918864097363 COMPASS 0.36727518593644354 COMPASS III 0.09722785665990534 COSMObase 0.0043272481406355645 COSMOconf 0.005138607167004733 COSMOmic 1.352265043948614E-4 COSMOperm 0.0012170385395537525 COSMOplex 1.352265043948614E-4 COSMOquick 0.0016227180527383367 COSMOtherm 0.06626098715348208 Catalyst 0.07937795807978364 Classical Simulations 1.0 Conformers 6.76132521974307E-4 Crystallization 0.07450980392156863 DFTB Plus 0.005273833671399594 DMol3 0.1720081135902637 DPD 0.002434077079107505 Discover 0.003786342123056119 Forcite 0.5605138607167005 GULP 0.02244759972954699 Kinetix 1.352265043948614E-4 LUDI 0.002839756592292089 LibDock 0.06031102096010818 LigandFit 0.003515889114266396 MCSS 4.0567951318458417E-4 MODELER 0.2129817444219067 MesoDyn 6.76132521974307E-4 Mesocite 0.0032454361054766734 Mesoscale 0.005949966193373901 Modules 0.0 Morphology 0.017714672075726842 ONETEP 9.465855307640297E-4 Polymorph 0.002028397565922921 QMERA 1.352265043948614E-4 QSAR 8.113590263691683E-4 Quantum Mechanics 0.5430696416497633 Reflex 0.053820148749154834 Reflex Plus 0.0012170385395537525 Semi-empirical 0.006896551724137931 Sorption 0.05909398242055443 Synthia 0.001352265043948614 TURBOMOLE 4.0567951318458417E-4 VAMP 0.0012170385395537525 Visualization 0.6505747126436782 X-Cell 0.0016227180527383367 ZDOCK 0.02434077079107505

Year

2023 0.03614103819784525 2024 0.4227228207639569 2025 1.0 2026 0.41625857002938293 2027 0.0

Keywords

target 1.0 potential 0.28315365631900247 analysis 0.19937654240810496 docking 0.18281595012339266 between 0.16092999090791013 visualization 0.15008442654890244 energy 0.10170151967788024 novel 0.09514222626315105 promising 0.0752695155214963 cell 0.0716976230679309 binding 0.05708533575789063 performance 0.0532536693077023 stability 0.04429146642421094 activity 0.03662813352383426 experimental 0.03188725808546564 effective 0.023249772697752955 synthesized 0.02292505520197428 including 0.022535394207039875 interaction 0.02143135472139239 mechanism 0.018898558254318742 development 0.01714508377711391 enhanced 0.014287569814261592 design 0.0027276269645408495 strong 0.0019483049746720352 synthesis 0.0
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