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Application

Discovery Studio 0.2891726523011439 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06456919596956612 Amorphous Cell 0.29816985399958873 Blends 0.0022619782027555007 CASTEP 0.017684556857906642 CDOCKER 0.061484680238535885 CHARMm 0.22516964836520667 COMPASS 0.35944889985605594 COMPASS III 0.10034957844951677 COSMObase 0.0 COSMOconf 0.0 COSMOplex 0.0 COSMOquick 2.0563438206868187E-4 COSMOtherm 0.0014394406744807733 Catalyst 0.011721159777914868 Classical Simulations 1.0 Conformers 4.1126876413736374E-4 Crystallization 0.035369113715813284 DFTB Plus 0.0022619782027555007 DMol3 0.03166769483857701 DPD 0.0010281719103434094 Discover 0.004112687641373638 Forcite 0.554595928439235 GULP 0.02056343820686819 Kinetix 0.0 LUDI 0.002056343820686819 LibDock 0.017067653711700596 LigandFit 0.002056343820686819 MODELER 0.03701418877236274 MesoDyn 2.0563438206868187E-4 Mesocite 0.0014394406744807733 Mesoscale 0.0028788813489615465 Modules 0.0 Morphology 0.017684556857906642 Polymorph 0.001850709438618137 QMERA 2.0563438206868187E-4 Quantum Mechanics 0.047501542257865514 Reflex 0.015216944273082459 Reflex Plus 0.0 Semi-empirical 0.0030845157310302285 Sorption 0.06004523956405511 Synthia 6.169031462060457E-4 VAMP 2.0563438206868187E-4 X-Cell 0.0 ZDOCK 0.007197203372403866

Year

2024 0.13916849015317287 2025 1.0 2026 0.9789934354485776 2027 0.0

Keywords

target 1.0 cell 0.2678475577026302 amorphous 0.21792807300053677 between 0.20853462157809985 performance 0.1623725174449812 potential 0.1583467525496511 energy 0.1556629092860977 analysis 0.10359634997316157 enhanced 0.06816961889425657 experimental 0.06280193236714976 adsorption 0.05448201825013419 strategy 0.0499194847020934 novel 0.04508856682769726 mechanism 0.043478260869565216 surface 0.040257648953301126 stability 0.03650026838432636 promising 0.030595813204508857 design 0.024154589371980676 interaction 0.017713365539452495 efficient 0.01583467525496511 effective 0.013687600644122383 temperature 0.011003757380568975 water 0.010466988727858293 docking 0.007246376811594203 formation 0.0
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