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Application

Discovery Studio 1.0 Materials Studio 0.7487228607918263 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04792332268370607 Amorphous Cell 0.25376540392514835 Blends 9.128251939753537E-4 CASTEP 0.25604746691008673 CDOCKER 0.20356001825650388 CHARMm 0.32177088087631217 COMPASS 0.31629392971246006 COMPASS III 0.10999543587403013 COSMObase 0.003651300775901415 COSMOconf 0.006846188954815153 COSMOmic 0.0 COSMOperm 4.5641259698767686E-4 COSMOplex 4.5641259698767686E-4 COSMOtherm 0.05796439981743496 Catalyst 0.08443633044272023 Classical Simulations 1.0 Conformers 4.5641259698767686E-4 Crystallization 0.06846188954815152 DFTB Plus 0.003194888178913738 DMol3 0.11912368781378366 DPD 0.0013692377909630307 Discover 0.003194888178913738 Forcite 0.4847101780009128 GULP 0.010953902327704245 Kinetix 0.0 LUDI 0.003194888178913738 LibDock 0.08215426745778183 LigandFit 0.004107713372889092 MODELER 0.29940666362391605 Mesocite 0.003651300775901415 Mesoscale 0.004564125969876769 Morphology 0.015518028297581013 ONETEP 9.128251939753537E-4 Polymorph 0.0018256503879507074 Quantum Mechanics 0.3710634413509813 Reflex 0.04974897307165678 Reflex Plus 0.0 Semi-empirical 0.004107713372889092 Sorption 0.057051574623459604 Synthia 9.128251939753537E-4 TURBOMOLE 0.0 VAMP 4.5641259698767686E-4 Visualization 0.7863989046097672 X-Cell 4.5641259698767686E-4 ZDOCK 0.03423094477407576

Year

2024 0.056388526727509776 2025 1.0 2026 0.8484354628422425 2027 0.0

Keywords

target 1.0 potential 0.3494083500781424 docking 0.2766242464835901 analysis 0.23688323286447868 visualization 0.19736548336682294 between 0.12234873855771378 binding 0.10471087296271489 promising 0.09801294931904443 novel 0.09689662871176602 activity 0.0685420852868944 cell 0.048001786112971644 energy 0.04643893726278187 stability 0.03907122125474436 including 0.033489618218352314 strong 0.03326635409689663 therapeutic 0.02277294038847957 development 0.017637865594998883 performance 0.01629828086626479 protein 0.01518196025898638 effective 0.014958696137530699 mechanism 0.012056262558606833 synthesized 0.010493413708417058 interaction 0.006028131279303416 strategy 0.0020093770931011385 enhanced 0.0
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