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Application

Discovery Studio 0.9189399844115355 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.055274067250115154 Amorphous Cell 0.27913403961308153 Blends 0.0023030861354214646 CASTEP 0.2860432980193459 CDOCKER 0.16213726393367112 CHARMm 0.2524182404421925 COMPASS 0.3468447719944726 COMPASS III 0.117918010133579 COSMObase 0.004145555043758637 COSMOconf 0.006909258406264394 COSMOmic 0.0 COSMOperm 4.6061722708429296E-4 COSMOplex 4.6061722708429296E-4 COSMOtherm 0.06448641179180101 Catalyst 0.06955320128972824 Classical Simulations 1.0 Conformers 4.6061722708429296E-4 Crystallization 0.07508060801473976 DFTB Plus 0.0032243205895900505 DMol3 0.13450023030861355 DPD 0.0013818516812528789 Discover 0.0032243205895900505 Forcite 0.5343159834177799 GULP 0.013818516812528788 Kinetix 0.0 LUDI 0.0013818516812528789 LibDock 0.06356517733763242 LigandFit 0.0032243205895900505 MODELER 0.228005527406725 Mesocite 0.004145555043758637 Mesoscale 0.005066789497927222 Morphology 0.016582220175034548 ONETEP 9.212344541685859E-4 Polymorph 0.0023030861354214646 QMERA 0.0 Quantum Mechanics 0.41501612160294793 Reflex 0.05481345002303086 Reflex Plus 0.0 Semi-empirical 0.004606172270842929 Sorption 0.06172270842929525 Synthia 9.212344541685859E-4 TURBOMOLE 0.0 VAMP 4.6061722708429296E-4 Visualization 0.6255181943804698 X-Cell 0.0013818516812528789 ZDOCK 0.027176416397973285

Year

2024 0.0 2025 0.8741698706745893 2026 1.0 2027 0.003495281370150297

Keywords

target 1.0 potential 0.31053283767038414 analysis 0.21288723667905823 docking 0.2047087980173482 visualization 0.14820322180916976 between 0.13457249070631971 promising 0.0919454770755886 novel 0.08698884758364313 energy 0.07360594795539034 binding 0.061957868649318466 cell 0.061462205700123916 performance 0.05105328376703842 activity 0.038661710037174724 stability 0.03841387856257745 strong 0.03370508054522924 including 0.02577447335811648 strategy 0.020322180916976455 enhanced 0.01883519206939281 mechanism 0.01685254027261462 development 0.015613382899628252 effective 0.012639405204460967 synthesized 0.003965303593556382 therapeutic 0.0022304832713754648 experimental 4.956629491945477E-4 design 0.0
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