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Application

Discovery Studio 0.7302487996508075 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07847663012117714 Amorphous Cell 0.29486439699942296 Blends 0.0 CASTEP 0.37795729948066936 CDOCKER 0.13848817080207732 CHARMm 0.22504327755337564 COMPASS 0.3739180611656088 COMPASS III 0.08540103866128101 COSMObase 0.0028851702250432777 COSMOconf 0.006924408540103866 COSMOperm 0.0 COSMOquick 0.0028851702250432777 COSMOtherm 0.07039815349105598 Catalyst 0.06231967686093479 Classical Simulations 1.0 Crystallization 0.07328332371609925 DFTB Plus 0.005770340450086555 DMol3 0.16676283900750144 DPD 0.001154068090017311 Discover 0.002308136180034622 Forcite 0.5718407386035776 GULP 0.019619157530294286 LUDI 0.002308136180034622 LibDock 0.05597230236583958 LigandFit 0.0028851702250432777 MODELER 0.2129255626081939 MesoDyn 0.0017311021350259665 Mesocite 0.002308136180034622 Mesoscale 0.005770340450086555 Morphology 0.017311021350259664 ONETEP 0.0 Polymorph 0.0 QSAR 0.0017311021350259665 Quantum Mechanics 0.536064627813041 Reflex 0.05366416618580496 Reflex Plus 5.770340450086555E-4 Semi-empirical 0.0075014425851125215 Sorption 0.044431621465666475 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.001154068090017311 Visualization 0.5799192152336988 X-Cell 0.002308136180034622 ZDOCK 0.023658395845354875

Year

2025 0.0

Keywords

target 1.0 potential 0.28791982665222104 analysis 0.18878656554712892 docking 0.17145178764897076 between 0.17009750812567714 visualization 0.12621885157096424 energy 0.1067172264355363 novel 0.09479956663055254 promising 0.08342361863488625 cell 0.07963163596966413 binding 0.06419284940411701 stability 0.054442036836403036 performance 0.05390032502708559 activity 0.04279523293607801 including 0.037107258938244854 experimental 0.03602383531960997 interaction 0.03114842903575298 effective 0.02789815817984832 strong 0.026814734561213433 enhanced 0.026543878656554713 development 0.025189599133261104 mechanism 0.01868905742145179 synthesized 0.017876489707475622 design 0.0051462621885157095 synthesis 0.0
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