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Application

Discovery Studio 0.808932602386327 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06633081444164568 Amorphous Cell 0.2938706968933669 Blends 0.001889168765743073 CASTEP 0.3608312342569269 CDOCKER 0.14777497900923595 CHARMm 0.22942905121746432 COMPASS 0.36314021830394627 COMPASS III 0.10306465155331654 COSMObase 0.004827875734676742 COSMOconf 0.006507136859781696 COSMOmic 0.0 COSMOperm 0.0010495382031905961 COSMOplex 2.0990764063811922E-4 COSMOquick 0.0010495382031905961 COSMOtherm 0.0709487825356843 Catalyst 0.07472712006717044 Classical Simulations 1.0 Conformers 4.1981528127623844E-4 Crystallization 0.07535684298908481 DFTB Plus 0.004827875734676742 DMol3 0.16309823677581864 DPD 0.0020990764063811922 Discover 0.003988245172124265 Forcite 0.5591939546599496 GULP 0.017632241813602016 Kinetix 2.0990764063811922E-4 LUDI 0.003568429890848027 LibDock 0.05919395465994962 LigandFit 0.0033585222502099076 MCSS 4.1981528127623844E-4 MODELER 0.22019311502938707 MesoDyn 2.0990764063811922E-4 Mesocite 0.002938706968933669 Mesoscale 0.005037783375314861 Morphology 0.018052057094878254 ONETEP 0.0010495382031905961 Polymorph 0.0020990764063811922 QMERA 2.0990764063811922E-4 QSAR 8.396305625524769E-4 Quantum Mechanics 0.5151133501259446 Reflex 0.05373635600335852 Reflex Plus 8.396305625524769E-4 Semi-empirical 0.006717044500419815 Sorption 0.060453400503778336 Synthia 0.0010495382031905961 TURBOMOLE 4.1981528127623844E-4 VAMP 0.0012594458438287153 Visualization 0.6393786733837111 X-Cell 0.001889168765743073 ZDOCK 0.026028547439126783

Year

2023 6.291286568103177E-4 2024 0.3079584775086505 2025 1.0 2026 0.6154451085246933 2027 0.0

Keywords

target 1.0 potential 0.28726933443914576 analysis 0.204955421936554 docking 0.18588015757827078 between 0.1506323864814431 visualization 0.14451586149699358 energy 0.09216255442670537 novel 0.08853410740203194 promising 0.07847812564793696 cell 0.06862948372382334 binding 0.05650010366991499 performance 0.05421936554012026 stability 0.041675305826249225 activity 0.036802819821687746 experimental 0.0284055567074435 including 0.022496371552975326 synthesized 0.019800953763217916 effective 0.018660584698320548 enhanced 0.01783122537839519 development 0.013580758863777732 strong 0.012958739373833713 mechanism 0.012647729628861704 interaction 0.005805515239477504 design 0.002488077959776073 strategy 0.0
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