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Application

Discovery Studio 1.0 Materials Studio 0.9982502187226596 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06539413220219159 Amorphous Cell 0.280311063980205 Blends 0.0017674089784376105 CASTEP 0.3343937787203959 CDOCKER 0.1728525980911983 CHARMm 0.27465535524920465 COMPASS 0.34676564156945916 COMPASS III 0.09261223047013079 COSMObase 0.003534817956875221 COSMOconf 0.006009190526687876 COSMOquick 0.0017674089784376105 COSMOtherm 0.06468716861081654 Catalyst 0.07635206786850478 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.0689289501590668 DFTB Plus 0.00671615411806292 DMol3 0.14916931778013431 DPD 0.002474372569812655 Discover 0.0017674089784376105 Forcite 0.5323435843054083 GULP 0.022269353128313893 Kinetix 0.0 LUDI 0.003888299752562743 LibDock 0.07175680452456698 LigandFit 0.003534817956875221 MODELER 0.2675857193354542 MesoDyn 0.0014139271827500884 Mesocite 0.0014139271827500884 Mesoscale 0.005655708731000354 Modules 0.0 Morphology 0.016260162601626018 ONETEP 3.534817956875221E-4 Polymorph 0.0014139271827500884 QSAR 0.0010604453870625664 Quantum Mechanics 0.4740190880169671 Reflex 0.04913396960056557 Reflex Plus 0.0010604453870625664 Semi-empirical 0.008130081300813009 Sorption 0.05160834217037823 Synthia 0.0010604453870625664 TURBOMOLE 3.534817956875221E-4 VAMP 0.0010604453870625664 Visualization 0.6832803110639802 X-Cell 0.0017674089784376105 ZDOCK 0.02863202545068929

Year

2025 0.0

Keywords

target 1.0 potential 0.3183805668016194 docking 0.21360323886639676 analysis 0.20761133603238865 visualization 0.1491497975708502 between 0.1468825910931174 novel 0.0968421052631579 promising 0.08923076923076922 binding 0.0788663967611336 energy 0.07821862348178138 cell 0.0617004048582996 activity 0.04728744939271255 stability 0.04097165991902834 including 0.04 performance 0.03255060728744939 development 0.022186234817813764 interaction 0.019433198380566803 strong 0.018947368421052633 effective 0.016356275303643725 experimental 0.016356275303643725 synthesized 0.012145748987854251 mechanism 0.009068825910931173 enhanced 0.008906882591093117 therapeutic 0.005182186234817814 synthesis 0.0
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