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Application

Discovery Studio 0.9743272926963207 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.061038514442916095 Amorphous Cell 0.2857634112792297 Blends 0.0020632737276478678 CASTEP 0.3476616231086658 CDOCKER 0.16420220082530948 CHARMm 0.25825309491059145 COMPASS 0.3502407152682256 COMPASS III 0.10299174690508942 COSMObase 0.004642365887207703 COSMOconf 0.005674002751031637 COSMOmic 1.71939477303989E-4 COSMOperm 0.001203576341127923 COSMOplex 1.71939477303989E-4 COSMOquick 0.001375515818431912 COSMOtherm 0.06740027510316368 Catalyst 0.08975240715268226 Classical Simulations 1.0 Conformers 3.43878954607978E-4 Crystallization 0.07118294360385144 DFTB Plus 0.0041265474552957355 DMol3 0.1576685006877579 DPD 0.002235213204951857 Discover 0.003782668500687758 Forcite 0.5367950481430537 GULP 0.0202888583218707 Kinetix 1.71939477303989E-4 LUDI 0.0034387895460797797 LibDock 0.06929160935350756 LigandFit 0.004298486932599725 MCSS 1.71939477303989E-4 MODELER 0.2405433287482806 MesoDyn 6.87757909215956E-4 Mesocite 0.002579092159559835 Mesoscale 0.00515818431911967 Modules 0.0 Morphology 0.01736588720770289 ONETEP 8.596973865199449E-4 Polymorph 0.0020632737276478678 QMERA 1.71939477303989E-4 QSAR 8.596973865199449E-4 Quantum Mechanics 0.4957015130674003 Reflex 0.05089408528198074 Reflex Plus 0.001203576341127923 Semi-empirical 0.005845942228335626 Sorption 0.05828748280605227 Synthia 0.001547455295735901 TURBOMOLE 1.71939477303989E-4 VAMP 0.001203576341127923 Visualization 0.7324621733149931 X-Cell 0.001203576341127923 ZDOCK 0.02768225584594223

Year

2023 0.0694314381270903 2024 0.4482943143812709 2025 1.0 2026 0.5640133779264214 2027 0.0

Keywords

target 1.0 potential 0.29656171994524516 docking 0.21531524277317013 analysis 0.20790723890812465 visualization 0.17312182945486754 between 0.15009260004831307 novel 0.09767292052500201 energy 0.08277639101376923 promising 0.07979708511152267 binding 0.0705370802802158 cell 0.06457846847572268 activity 0.04968193896448989 stability 0.03993880344633223 performance 0.038892020291488846 including 0.021660359127143893 synthesized 0.021579837346002093 experimental 0.01972783637974072 development 0.017956357194621145 effective 0.016990095820919558 mechanism 0.015701747322650776 interaction 0.015057573073516387 enhanced 0.008374265238747082 strong 0.0029793059022465576 protein 0.00281826233996296 design 0.0
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