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Application

Discovery Studio 1.0 Materials Studio 0.920036141856788 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05968858131487889 Amorphous Cell 0.27364475201845445 Blends 0.002018454440599769 CASTEP 0.31430219146482125 CDOCKER 0.17387543252595156 CHARMm 0.28460207612456745 COMPASS 0.3292964244521338 COMPASS III 0.10322952710495963 COSMObase 0.004325259515570935 COSMOconf 0.00720876585928489 COSMOmic 0.0 COSMOperm 5.767012687427913E-4 COSMOplex 2.883506343713956E-4 COSMOquick 8.650519031141869E-4 COSMOtherm 0.06459054209919261 Catalyst 0.08246828143021914 Classical Simulations 1.0 Conformers 2.883506343713956E-4 Crystallization 0.07093425605536333 DFTB Plus 0.002306805074971165 DMol3 0.14186851211072665 DPD 0.0011534025374855825 Discover 0.004325259515570935 Forcite 0.5155709342560554 GULP 0.01787773933102653 Kinetix 0.0 LUDI 0.004325259515570935 LibDock 0.07583621683967705 LigandFit 0.004036908881199538 MCSS 5.767012687427913E-4 MODELER 0.27162629757785467 MesoDyn 5.767012687427913E-4 Mesocite 0.0031718569780853517 Mesoscale 0.004901960784313725 Morphology 0.01643598615916955 ONETEP 5.767012687427913E-4 Polymorph 0.0014417531718569781 QMERA 0.0 QSAR 5.767012687427913E-4 Quantum Mechanics 0.4469434832756632 Reflex 0.052191464821222604 Reflex Plus 0.0 Semi-empirical 0.003748558246828143 Sorption 0.05334486735870819 Synthia 8.650519031141869E-4 TURBOMOLE 0.0 VAMP 8.650519031141869E-4 Visualization 0.7228950403690888 X-Cell 0.0017301038062283738 ZDOCK 0.03344867358708189

Year

2024 0.3230769230769231 2025 1.0 2026 0.7219620958751394 2027 0.0

Keywords

target 1.0 potential 0.3180305131761442 docking 0.23273231622746185 analysis 0.2185852981969487 visualization 0.16879334257975034 between 0.1403606102635229 novel 0.09958391123439667 promising 0.08640776699029126 binding 0.08141470180305131 energy 0.06338418862690708 cell 0.05742024965325936 activity 0.05159500693481276 stability 0.03952843273231623 performance 0.026768377253814146 including 0.024687933425797504 development 0.01636615811373093 strong 0.0159500693481276 effective 0.013869625520110958 mechanism 0.012205270457697643 synthesized 0.009153952843273232 enhanced 0.007489597780859916 protein 0.0062413314840499305 experimental 0.005131761442441054 interaction 0.0048543689320388345 therapeutic 0.0
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