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Application

Discovery Studio 1.0 Materials Studio 0.8556847851887016 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05690799873537781 Amorphous Cell 0.26557066076509644 Blends 0.002213088839709137 CASTEP 0.297502371166614 CDOCKER 0.18242175150173887 CHARMm 0.29781852671514386 COMPASS 0.3278533038254821 COMPASS III 0.10275055327220993 COSMObase 0.00474233322794815 COSMOconf 0.006639266519127411 COSMOmic 0.0 COSMOperm 6.323110970597534E-4 COSMOplex 3.161555485298767E-4 COSMOquick 3.161555485298767E-4 COSMOtherm 0.061966487511855836 Catalyst 0.08283275371482769 Classical Simulations 1.0 Conformers 3.161555485298767E-4 Crystallization 0.07018653177363263 DFTB Plus 0.002529244388239014 DMol3 0.13689535251343662 DPD 0.001264622194119507 Discover 0.00474233322794815 Forcite 0.5033196332595637 GULP 0.014226999683844452 Kinetix 0.0 LUDI 0.00474233322794815 LibDock 0.07777426493834967 LigandFit 0.004110022130888397 MCSS 3.161555485298767E-4 MODELER 0.28232690483717987 MesoDyn 6.323110970597534E-4 Mesocite 0.003161555485298767 Mesoscale 0.005058488776478028 Morphology 0.01612393297502371 ONETEP 6.323110970597534E-4 Polymorph 0.0018969332911792601 QMERA 0.0 QSAR 3.161555485298767E-4 Quantum Mechanics 0.4261776794182738 Reflex 0.05121719886184003 Reflex Plus 0.0 Semi-empirical 0.004110022130888397 Sorption 0.05374644325007904 Synthia 6.323110970597534E-4 TURBOMOLE 0.0 VAMP 9.484666455896301E-4 Visualization 0.7423332279481505 X-Cell 0.001264622194119507 ZDOCK 0.0325640214985773

Year

2024 0.26435315131411075 2025 1.0 2026 0.8800714467976525 2027 0.0

Keywords

target 1.0 potential 0.33364355514192645 docking 0.256243213897937 analysis 0.23390724367923066 visualization 0.18132464712269272 between 0.13835892663254226 novel 0.10252830774003413 promising 0.09896075694121297 binding 0.09585853885528153 activity 0.05754614549402823 energy 0.05754614549402823 cell 0.05599503645106251 stability 0.04312083139444703 including 0.029936404529238406 strong 0.026058631921824105 performance 0.024507522878858382 development 0.0210950829843338 effective 0.017992864898402357 mechanism 0.013649759578098341 synthesized 0.012408872343725764 therapeutic 0.011943539630836048 protein 0.010702652396463471 enhanced 0.00760043431053203 interaction 0.006669768884752598 experimental 0.0
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