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Application

Discovery Studio 0.8216019417475728 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07652043868394816 Amorphous Cell 0.2756729810568295 Blends 0.0032402791625124627 CASTEP 0.47208374875373876 CDOCKER 0.1485543369890329 CHARMm 0.2382851445663011 COMPASS 0.4202392821535394 COMPASS III 0.04511465603190429 COSMObase 9.970089730807576E-4 COSMOconf 7.477567298105683E-4 COSMOmic 2.492522432701894E-4 COSMOperm 0.0014955134596211367 COSMOplex 2.492522432701894E-4 COSMOquick 0.0014955134596211367 COSMOtherm 0.06256231306081755 Catalyst 0.10019940179461616 Classical Simulations 1.0 Conformers 0.0012462612163509472 Crystallization 0.08698903290129611 DFTB Plus 0.007477567298105683 DMol3 0.22083748753738783 DPD 0.00448654037886341 Discover 0.005732801595214357 Forcite 0.5361415752741775 GULP 0.03589232303090728 Kinetix 0.0 LUDI 0.0024925224327018943 LibDock 0.06331006979062812 LigandFit 0.00448654037886341 MCSS 7.477567298105683E-4 MODELER 0.22507477567298106 MesoDyn 0.003489531405782652 Mesocite 0.005982053838484547 Mesoscale 0.011714855433698903 Morphology 0.018195413758723827 ONETEP 0.0012462612163509472 Polymorph 0.0019940179461615153 QMERA 2.492522432701894E-4 QSAR 0.0019940179461615153 Quantum Mechanics 0.6802093718843469 Reflex 0.06679960119641076 Semi-empirical 0.010717846460618146 Sorption 0.05009970089730808 Synthia 0.001744765702891326 TURBOMOLE 7.477567298105683E-4 VAMP 0.0024925224327018943 Visualization 0.7138584247258225 X-Cell 4.985044865403788E-4 ZDOCK 0.024925224327018942

Year

2024 0.0

Keywords

target 1.0 potential 0.25892011367224504 docking 0.17840227344490053 analysis 0.17598147563414376 between 0.1666140406273024 visualization 0.14345858330702033 energy 0.09156930849384275 novel 0.08914851068308599 binding 0.04967898115987791 cell 0.0473634354278497 interaction 0.04167982317650774 activity 0.039259025365750974 promising 0.03683822755499421 experimental 0.03673297547626565 stability 0.028944321650352593 mechanism 0.019682138722239763 effective 0.0193663824860541 synthesized 0.01873487001368277 development 0.009788443321755604 including 0.007578149668455952 synthesis 0.0049468477002420795 protein 0.0038943269129565307 chemical 0.0025260498894853173 well 5.262603936427745E-4 performance 0.0
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