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Application

Discovery Studio 1.0 Materials Studio 0.9565842814175494 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060119555935098205 Amorphous Cell 0.27463706233988044 Blends 0.0025619128949615714 CASTEP 0.3542271562766866 CDOCKER 0.17472245943637915 CHARMm 0.2707087959009394 COMPASS 0.34551665243381724 COMPASS III 0.09769427839453458 COSMObase 0.0044406490179333905 COSMOconf 0.00529461998292058 COSMOmic 1.707941929974381E-4 COSMOperm 0.0013663535439795047 COSMOplex 1.707941929974381E-4 COSMOquick 8.539709649871904E-4 COSMOtherm 0.06336464560204953 Catalyst 0.10230572160546542 Classical Simulations 1.0 Conformers 5.123825789923143E-4 Crystallization 0.07190435525192143 DFTB Plus 0.004953031596925704 DMol3 0.161400512382579 DPD 0.0023911187019641333 Discover 0.004099060631938514 Forcite 0.5280956447480786 GULP 0.020324508966695132 Kinetix 3.415883859948762E-4 LUDI 0.0034158838599487617 LibDock 0.07241673783091375 LigandFit 0.0044406490179333905 MCSS 0.0 MODELER 0.23501280956447482 MesoDyn 6.831767719897524E-4 Mesocite 0.0025619128949615714 Mesoscale 0.005465414175918019 Modules 0.0 Morphology 0.017079419299743808 ONETEP 0.0010247651579846286 Polymorph 0.0023911187019641333 QMERA 1.707941929974381E-4 QSAR 6.831767719897524E-4 Quantum Mechanics 0.5057216054654142 Reflex 0.0515798462852263 Reflex Plus 0.0011955593509820667 Semi-empirical 0.00631938514090521 Sorption 0.05721605465414176 Synthia 0.0015371477369769428 TURBOMOLE 1.707941929974381E-4 VAMP 8.539709649871904E-4 Visualization 0.7895815542271563 X-Cell 0.0011955593509820667 ZDOCK 0.028693424423569598

Year

2022 0.0 2023 0.16151704018034743 2024 0.43004906511072805 2025 1.0 2026 0.5450205543031428 2027 0.0013260840737302744

Keywords

target 1.0 potential 0.3027285557472166 docking 0.23239767915947937 analysis 0.21209032460404578 visualization 0.19225341069468402 between 0.1486592441586953 novel 0.10153677277716795 energy 0.07848518111964874 promising 0.07832836757095812 binding 0.07809314724792223 cell 0.06100047044064607 activity 0.05692331817469029 stability 0.03794887878312686 performance 0.03206837070722911 synthesized 0.025874235533950133 interaction 0.023678845852281638 development 0.02030735455543359 including 0.019366473263289948 effective 0.017955151325074487 experimental 0.016700642935549632 mechanism 0.01646542261251372 protein 0.010663321310961267 synthesis 0.0053316606554806335 enhanced 0.003057864199466834 strong 0.0
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