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Application

Discovery Studio 0.8070034443168772 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06775274056029233 Amorphous Cell 0.29293544457978077 Blends 0.00243605359317905 CASTEP 0.3801766138855055 CDOCKER 0.14327040194884288 CHARMm 0.23066382460414128 COMPASS 0.3623629719853837 COMPASS III 0.09972594397076735 COSMObase 0.004263093788063338 COSMOconf 0.0057856272838002435 COSMOmic 0.0 COSMOperm 9.135200974421437E-4 COSMOplex 1.522533495736906E-4 COSMOquick 0.0013702801461632156 COSMOtherm 0.06836175395858708 Cantera 0.0 Catalyst 0.08069427527405602 Classical Simulations 1.0 Conformers 4.5676004872107184E-4 Crystallization 0.07369062119366626 DFTB Plus 0.0057856272838002435 DMol3 0.1702192448233861 DPD 0.00243605359317905 Discover 0.003958587088915956 Forcite 0.5560292326431181 GULP 0.021010962241169304 Kinetix 3.045066991473812E-4 LUDI 0.003501827040194884 LibDock 0.06014007308160779 LigandFit 0.0036540803897685747 MCSS 4.5676004872107184E-4 MODELER 0.21193666260657734 MesoDyn 7.612667478684531E-4 Mesocite 0.0027405602923264312 Mesoscale 0.0054811205846528625 Modules 0.0 Morphology 0.01705237515225335 ONETEP 0.001218026796589525 Polymorph 0.001979293544457978 QMERA 1.522533495736906E-4 QSAR 9.135200974421437E-4 Quantum Mechanics 0.5398903775883069 Reflex 0.0535931790499391 Reflex Plus 9.135200974421437E-4 Semi-empirical 0.00746041412911084 Sorption 0.05937880633373934 Synthia 0.0013702801461632156 TURBOMOLE 4.5676004872107184E-4 VAMP 0.001218026796589525 Visualization 0.6612362971985384 X-Cell 0.0015225334957369061 ZDOCK 0.025274056029232644

Year

2023 0.06047096479195244 2024 0.40866483767718337 2025 1.0 2026 0.48525377229080935 2027 0.0

Keywords

target 1.0 potential 0.28809471607103704 analysis 0.19915223269750787 docking 0.18709347365343856 between 0.16224512168384125 visualization 0.15384053204706571 energy 0.10158590952276547 novel 0.09486223781334503 promising 0.07644522400058466 cell 0.07184097054739458 binding 0.058466710516699556 performance 0.05327778995834247 stability 0.04472703354527516 activity 0.04114594752612731 experimental 0.031572023679017756 including 0.024629101805159686 synthesized 0.022655850325221077 effective 0.020097931740115472 interaction 0.019001680917927356 development 0.017978513483885114 enhanced 0.017832346707593365 mechanism 0.0165899291091135 strong 0.007966089307900314 design 0.006504421544982825 synthesis 0.0
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