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Application

Discovery Studio 1.0 Materials Studio 0.959480122324159 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04597701149425287 Amorphous Cell 0.27586206896551724 Blends 8.841732979664014E-4 CASTEP 0.23342175066312998 CDOCKER 0.16268788682581786 CHARMm 0.2546419098143236 COMPASS 0.34305923961096374 COMPASS III 0.1184792219274978 COSMObase 0.002652519893899204 COSMOconf 0.011494252873563218 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 8.841732979664014E-4 COSMOtherm 0.06984969053934571 Catalyst 0.08664898320070734 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08222811671087533 DFTB Plus 0.002652519893899204 DMol3 0.11140583554376658 DPD 0.0017683465959328027 Discover 0.0035366931918656055 Forcite 0.5358090185676393 GULP 0.008841732979664015 Kinetix 0.0 LUDI 0.0017683465959328027 LibDock 0.06984969053934571 LigandFit 0.002652519893899204 MODELER 0.2484526967285588 Mesocite 0.004420866489832007 Mesoscale 0.00618921308576481 Morphology 0.020335985853227233 ONETEP 0.0017683465959328027 Polymorph 8.841732979664014E-4 Quantum Mechanics 0.34394341290893016 Reflex 0.05747126436781609 Semi-empirical 0.002652519893899204 Sorption 0.0618921308576481 Synthia 0.0017683465959328027 TURBOMOLE 0.0 Visualization 0.6622458001768347 X-Cell 0.0 ZDOCK 0.02475685234305924

Year

2025 0.9821937321937322 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.3097385031559964 docking 0.22272317403065825 analysis 0.21731289449954913 visualization 0.15960324616771868 between 0.12037871956717763 novel 0.09783588818755636 promising 0.09558160504959423 binding 0.07303877366997295 cell 0.06627592425608657 energy 0.05590622182146077 activity 0.046889089269612265 stability 0.04328223624887286 performance 0.03787195671776375 including 0.034715960324616775 strong 0.031559963931469794 strategy 0.031109107303877368 therapeutic 0.02750225428313796 synthesized 0.023895401262398558 development 0.022091974752028856 mechanism 0.019837691614066726 effective 0.013976555455365193 enhanced 0.010820559062218215 design 0.009467989179440937 synthesis 0.0
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