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Application

Discovery Studio 0.6515513126491647 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05754857997010463 Amorphous Cell 0.2952167414050822 Blends 0.002242152466367713 CASTEP 0.29970104633781763 CDOCKER 0.12481315396113603 CHARMm 0.1920777279521674 COMPASS 0.36472346786248133 COMPASS III 0.13153961136023917 COSMObase 0.0037369207772795215 COSMOconf 0.008968609865470852 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0 COSMOtherm 0.07025411061285501 Catalyst 0.05904334828101644 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07997010463378176 DFTB Plus 0.0014947683109118087 DMol3 0.13079222720478326 DPD 0.0014947683109118087 Discover 0.002242152466367713 Forcite 0.5762331838565022 GULP 0.012705530642750373 Kinetix 0.0 LUDI 0.0 LibDock 0.04708520179372197 LigandFit 0.002242152466367713 MODELER 0.1741405082212257 Mesocite 0.00523168908819133 Mesoscale 0.006726457399103139 Morphology 0.017937219730941704 ONETEP 0.0014947683109118087 Polymorph 7.473841554559044E-4 Quantum Mechanics 0.42750373692077726 Reflex 0.05904334828101644 Semi-empirical 0.002242152466367713 Sorption 0.06203288490284006 Synthia 7.473841554559044E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.5044843049327354 ZDOCK 0.01943198804185351

Year

2025 0.6329930145083289 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.27075184702303345 analysis 0.19252498913515861 docking 0.14732724902216426 between 0.14515428074750109 visualization 0.10821382007822686 energy 0.09126466753585398 promising 0.08952629291612342 cell 0.08518035636679705 performance 0.0812690134724033 novel 0.07301173402868318 stability 0.042590178183398525 enhanced 0.042155584528465885 strategy 0.04041720990873533 strong 0.03389830508474576 binding 0.03259452411994785 activity 0.02216427640156454 effective 0.018687527162103434 mechanism 0.017818339852238158 design 0.013906996957844416 including 0.012603215993046502 development 0.009561060408518035 experimental 0.009561060408518035 synthesized 0.00651890482398957 efficient 0.0
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