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Application

Discovery Studio 1.0 Materials Studio 0.9842653384650215 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06224899598393574 Amorphous Cell 0.2815547905909352 Blends 0.002008032128514056 CASTEP 0.34968445209409066 CDOCKER 0.16609294320137694 CHARMm 0.2689328743545611 COMPASS 0.3463855421686747 COMPASS III 0.0950946643717728 COSMObase 0.004159495123350545 COSMOconf 0.0050200803212851405 COSMOmic 1.4343086632243257E-4 COSMOperm 7.17154331612163E-4 COSMOplex 1.4343086632243257E-4 COSMOquick 0.0015777395295467585 COSMOtherm 0.06411359724612736 Catalyst 0.10083189902467012 Classical Simulations 1.0 Conformers 4.302925989672978E-4 Crystallization 0.06812966150315548 DFTB Plus 0.004733218588640275 DMol3 0.15734366035570854 DPD 0.002008032128514056 Discover 0.0034423407917383822 Forcite 0.5292598967297762 GULP 0.019506597819850834 Kinetix 1.4343086632243257E-4 LUDI 0.0034423407917383822 LibDock 0.06913367756741251 LigandFit 0.004302925989672977 MCSS 5.737234652897303E-4 MODELER 0.23838209982788297 MesoDyn 5.737234652897303E-4 Mesocite 0.003155479059093517 Mesoscale 0.005450372920252439 Modules 0.0 Morphology 0.015920826161790018 ONETEP 8.605851979345956E-4 Polymorph 0.002008032128514056 QMERA 1.4343086632243257E-4 QSAR 7.17154331612163E-4 Quantum Mechanics 0.49713138267355134 Reflex 0.04905335628227195 Reflex Plus 8.605851979345956E-4 Semi-empirical 0.006310958118187034 Sorption 0.055507745266781414 Synthia 8.605851979345956E-4 TURBOMOLE 4.302925989672978E-4 VAMP 0.0011474469305794606 Visualization 0.7670682730923695 X-Cell 0.0015777395295467585 ZDOCK 0.02725186460126219

Year

2023 0.1114695739236845 2024 0.5172989209033263 2025 1.0 2026 0.4725775948381355 2027 0.0

Keywords

target 1.0 potential 0.29834471886495006 docking 0.22471098265895953 analysis 0.20743562795585918 visualization 0.18529952706253283 between 0.14923804519180242 novel 0.10109038360483447 energy 0.07980819758276406 binding 0.07369942196531792 promising 0.07330530740935365 cell 0.06292695743562796 activity 0.05228586442459275 stability 0.03980557015239096 performance 0.033631108775617445 synthesized 0.02325275880189175 including 0.02167630057803468 interaction 0.02141355754072517 experimental 0.020428271150814505 effective 0.01780084077771939 development 0.01720966894377299 mechanism 0.0162900683131897 protein 0.012743037309511297 synthesis 0.005714661061481871 enhanced 0.005254860746190226 design 0.0
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