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Application

Discovery Studio 0.8640412564463197 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05172413793103448 Amorphous Cell 0.2875417130144605 Blends 0.002224694104560623 CASTEP 0.27308120133481645 CDOCKER 0.1507230255839822 CHARMm 0.23915461624026696 COMPASS 0.3520578420467186 COMPASS III 0.12458286985539488 COSMObase 0.0033370411568409346 COSMOconf 0.00778642936596218 COSMOmic 0.0 COSMOperm 5.561735261401557E-4 COSMOplex 5.561735261401557E-4 COSMOtherm 0.06451612903225806 Catalyst 0.06952169076751946 Classical Simulations 1.0 Conformers 5.561735261401557E-4 Crystallization 0.07897664071190211 DFTB Plus 0.00389321468298109 DMol3 0.13181312569521692 DPD 0.0016685205784204673 Discover 0.00389321468298109 Forcite 0.5472747497219133 GULP 0.01167964404894327 Kinetix 0.0 LUDI 0.0011123470522803114 LibDock 0.058954393770856504 LigandFit 0.0033370411568409346 MODELER 0.21078976640711902 Mesocite 0.00389321468298109 Mesoscale 0.005005561735261402 Morphology 0.01835372636262514 ONETEP 0.0011123470522803114 Polymorph 0.0027808676307007787 QMERA 0.0 Quantum Mechanics 0.39988876529477196 Reflex 0.05617352614015573 Reflex Plus 0.0 Semi-empirical 0.004449388209121246 Sorption 0.06674082313681869 Synthia 0.0011123470522803114 TURBOMOLE 0.0 Visualization 0.6045606229143493 X-Cell 0.0016685205784204673 ZDOCK 0.02502780867630701

Year

2024 0.0 2025 0.8257575757575758 2026 1.0 2027 0.004208754208754209

Keywords

target 1.0 potential 0.2949969493593655 analysis 0.20683343502135448 docking 0.19463087248322147 visualization 0.13880414887126297 between 0.1333129957291031 promising 0.0848078096400244 energy 0.07596095179987797 novel 0.07474069554606468 cell 0.06223306894447834 binding 0.05582672361195851 performance 0.05216595485051861 stability 0.03569249542403905 activity 0.0326418547895058 strong 0.028065893837705917 strategy 0.02593044539353264 including 0.02410006101281269 mechanism 0.014338010982306285 enhanced 0.012812690665039659 development 0.009762050030506406 effective 0.006406345332519829 therapeutic 0.003355704697986577 experimental 0.0021354484441732766 design 6.101281269066504E-4 synthesized 0.0
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