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Application

Discovery Studio 0.8118182680451485 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0679106372175679 Amorphous Cell 0.29144452906829144 Blends 0.002538715410002539 CASTEP 0.3882965219598883 CDOCKER 0.14178725564864178 CHARMm 0.22988068037572987 COMPASS 0.3667174409748667 COMPASS III 0.09482102056359482 COSMObase 0.004188880426504189 COSMOconf 0.005204366590505204 COSMOmic 1.2693577050012695E-4 COSMOperm 0.0012693577050012694 COSMOplex 2.538715410002539E-4 COSMOquick 0.0015232292460015233 COSMOtherm 0.066006600660066 Cantera 0.0 Catalyst 0.08606245239908607 Classical Simulations 1.0 Conformers 7.616146230007616E-4 Crystallization 0.07298806803757299 DFTB Plus 0.005585173902005585 DMol3 0.17415587712617417 DPD 0.002538715410002539 Discover 0.0036811373445036813 Forcite 0.5591520690530591 GULP 0.022213759837522214 Kinetix 2.538715410002539E-4 LUDI 0.0030464584920030465 LibDock 0.06054836252856055 LigandFit 0.003554201574003554 MCSS 3.808073115003808E-4 MODELER 0.21007870017771008 MesoDyn 7.616146230007616E-4 Mesocite 0.0033003300330033004 Mesoscale 0.006092916984006093 Modules 0.0 Morphology 0.01688245747651688 ONETEP 0.0012693577050012694 Polymorph 0.002030972328002031 QMERA 1.2693577050012695E-4 QSAR 8.885503935008886E-4 Quantum Mechanics 0.5512820512820513 Reflex 0.05293221629855293 Reflex Plus 0.0011424219345011425 Semi-empirical 0.007108403148007108 Sorption 0.05965981213505966 Synthia 0.0013962934755013963 TURBOMOLE 6.346788525006347E-4 VAMP 0.0011424219345011425 Visualization 0.6782178217821783 X-Cell 0.0015232292460015233 ZDOCK 0.024244732165524245

Year

2023 0.08011204481792718 2024 0.45406162464985994 2025 1.0 2026 0.3968253968253968 2027 0.0

Keywords

target 1.0 potential 0.2846399133626136 analysis 0.19776186751699656 docking 0.1880151615426268 between 0.16256542927621684 visualization 0.1593766921364539 energy 0.1024607424342699 novel 0.096083268154744 promising 0.07406293243487155 cell 0.07105468985018952 binding 0.05805908188436316 performance 0.04969616749894711 stability 0.044100836291438544 activity 0.04115275855845015 experimental 0.03266951446964683 interaction 0.02400577582576259 synthesized 0.023584621863907106 including 0.022682149088502496 effective 0.021418687202936045 mechanism 0.02003489561398231 development 0.01792912580470489 enhanced 0.012514289152277239 design 0.003248901991456591 synthesis 0.0012032970338728115 strong 0.0
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