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Application

Discovery Studio 1.0 Materials Studio 0.12288512911843277 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.013513513513513514 Amorphous Cell 0.04623044096728307 Blends 0.0 CASTEP 0.051209103840682786 CDOCKER 0.19132290184921763 CHARMm 0.23826458036984352 COMPASS 0.06827880512091039 COMPASS III 0.001422475106685633 COSMOconf 0.0 COSMOtherm 0.008534850640113799 Catalyst 0.18278805120910385 Classical Simulations 0.3627311522048364 Crystallization 0.010668563300142247 DMol3 0.025604551920341393 DPD 0.001422475106685633 Discover 0.0021337126600284497 Forcite 0.0860597439544808 GULP 0.0035561877667140826 LUDI 0.008534850640113799 LibDock 0.08463726884779517 LigandFit 0.006401137980085348 MCSS 0.0021337126600284497 MODELER 0.0953058321479374 Mesocite 0.001422475106685633 Mesoscale 0.0021337126600284497 Morphology 0.0021337126600284497 ONETEP 0.0 QSAR 7.112375533428165E-4 Quantum Mechanics 0.07467994310099574 Reflex 0.007823613086770981 Sorption 0.0021337126600284497 Visualization 1.0 ZDOCK 0.044096728307254626

Year

2022 0.0

Keywords

target 1.0 visualization 0.48344988344988343 docking 0.4461538461538462 potential 0.26153846153846155 binding 0.17529137529137528 analysis 0.15757575757575756 activity 0.151981351981352 protein 0.13053613053613053 novel 0.11561771561771562 silico 0.08205128205128205 between 0.07692307692307693 vitro 0.07365967365967366 synthesis 0.07226107226107226 interaction 0.06526806526806526 compound 0.06013986013986014 drug 0.05687645687645688 inhibition 0.047086247086247084 treatment 0.03822843822843823 synthesized 0.037296037296037296 development 0.012121212121212121 cell 0.011655011655011656 mechanism 0.006526806526806527 active 9.324009324009324E-4 well 4.662004662004662E-4 design 0.0
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