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Application

Discovery Studio 1.0 Materials Studio 0.8284327719097916 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05474171164225135 Amorphous Cell 0.2636854279105628 Blends 0.002313030069390902 CASTEP 0.284502698535081 CDOCKER 0.1900539707016191 CHARMm 0.3072474942174248 COMPASS 0.3226676946800308 COMPASS III 0.09946029298380879 COSMObase 0.0038550501156515036 COSMOconf 0.006939090208172706 COSMOmic 0.0 COSMOperm 7.710100231303007E-4 COSMOplex 3.8550501156515033E-4 COSMOquick 0.0 COSMOtherm 0.06090979182729375 Catalyst 0.08519660755589822 Classical Simulations 1.0 Conformers 3.8550501156515033E-4 Crystallization 0.07016191210485737 DFTB Plus 0.0019275250578257518 DMol3 0.1341557440246723 DPD 0.0015420200462606013 Discover 0.005782575173477255 Forcite 0.5019275250578258 GULP 0.013107170393215111 Kinetix 0.0 LUDI 0.004240555127216654 LibDock 0.07825751734772551 LigandFit 0.003469545104086353 MODELER 0.2848882035466461 MesoDyn 7.710100231303007E-4 Mesocite 0.003469545104086353 Mesoscale 0.005782575173477255 Morphology 0.016962220508866616 ONETEP 7.710100231303007E-4 Polymorph 0.0019275250578257518 QMERA 0.0 QSAR 3.8550501156515033E-4 Quantum Mechanics 0.4117193523515806 Reflex 0.05011565150346955 Reflex Plus 0.0 Semi-empirical 0.0026985350809560524 Sorption 0.05088666152659985 Synthia 7.710100231303007E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7474942174248265 X-Cell 0.0015420200462606013 ZDOCK 0.03392444101773323

Year

2024 0.16136562591187628 2025 1.0 2026 0.8427195798074117 2027 0.0

Keywords

target 1.0 potential 0.3298735610492546 docking 0.2594829213059068 analysis 0.2275901113417626 visualization 0.1800339686733346 between 0.13285525570862428 novel 0.10266087941120966 binding 0.09624457444800906 promising 0.0954897150405737 activity 0.06095489715040574 cell 0.055859596150217024 energy 0.046235138705416116 stability 0.0411398377052274 including 0.026986223815814305 strong 0.02585393470466126 development 0.020947348556331385 performance 0.020003774297037178 effective 0.015852047556142668 therapeutic 0.015474617852424986 mechanism 0.010001887148518589 synthesized 0.009624457444800906 protein 0.006982449518777128 enhanced 0.005472730703906397 interaction 0.0035855821853179844 strategy 0.0
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