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Application

Discovery Studio 1.0 Materials Studio 0.8417508417508418 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04353932584269663 Amorphous Cell 0.23735955056179775 Blends 0.0 CASTEP 0.20926966292134833 CDOCKER 0.1797752808988764 CHARMm 0.2893258426966292 COMPASS 0.32303370786516855 COMPASS III 0.10814606741573034 COSMObase 0.0014044943820224719 COSMOconf 0.011235955056179775 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0014044943820224719 COSMOtherm 0.06601123595505617 Catalyst 0.09410112359550561 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.0800561797752809 DFTB Plus 0.0028089887640449437 DMol3 0.11657303370786516 Discover 0.0 Forcite 0.5140449438202247 GULP 0.012640449438202247 Kinetix 0.0 LUDI 0.0014044943820224719 LibDock 0.08146067415730338 LigandFit 0.004213483146067416 MODELER 0.26685393258426965 Mesocite 0.0028089887640449437 Mesoscale 0.0028089887640449437 Morphology 0.021067415730337078 ONETEP 0.0014044943820224719 Polymorph 0.0014044943820224719 Quantum Mechanics 0.32724719101123595 Reflex 0.05337078651685393 Semi-empirical 0.0028089887640449437 Sorption 0.06460674157303371 Visualization 0.6839887640449438 X-Cell 0.0 ZDOCK 0.03089887640449438

Year

2025 1.0 2026 0.8969957081545065 2027 0.0

Keywords

target 1.0 potential 0.3323843416370107 docking 0.23558718861209965 analysis 0.21494661921708186 visualization 0.1608540925266904 between 0.12669039145907474 novel 0.10106761565836299 promising 0.09181494661921709 binding 0.07758007117437722 cell 0.048398576512455514 therapeutic 0.04128113879003559 energy 0.03701067615658363 including 0.034875444839857654 activity 0.03416370106761566 stability 0.032740213523131674 strategy 0.03202846975088968 strong 0.025622775800711744 development 0.0199288256227758 performance 0.0199288256227758 synthesized 0.01494661921708185 mechanism 0.006405693950177936 effective 0.0056939501779359435 synthesis 0.0056939501779359435 enhanced 0.0014234875444839859 protein 0.0
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