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Application

Discovery Studio 1.0 Materials Studio 0.9863232435434601 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06729883999263488 Amorphous Cell 0.278493831706868 Blends 0.0024857300681274167 CASTEP 0.38897072362364205 CDOCKER 0.1695820290922482 CHARMm 0.25943656785122443 COMPASS 0.3651261277849383 COMPASS III 0.08037193886945314 COSMObase 0.003406370834100534 COSMOconf 0.0039587552936844045 COSMOmic 9.206407659731172E-5 COSMOperm 0.0012888970723623642 COSMOplex 2.761922297919352E-4 COSMOquick 0.0012888970723623642 COSMOtherm 0.06241944393297735 Cantera 0.0 Catalyst 0.12833732277665255 Classical Simulations 1.0 Conformers 8.285766893758056E-4 Crystallization 0.07475603019701713 DFTB Plus 0.005707972749033327 DMol3 0.17556619407107346 DPD 0.002946050451113975 Discover 0.003774627140489781 Forcite 0.532774811268643 GULP 0.024765236604676857 Kinetix 2.761922297919352E-4 LUDI 0.00478733198306021 LibDock 0.07180997974590315 LigandFit 0.005984164978825262 MCSS 7.365126127784938E-4 MODELER 0.1821027435094826 MesoDyn 0.0012888970723623642 Mesocite 0.00423494752347634 Mesoscale 0.00745719020438225 Modules 0.0 Morphology 0.017768366783281163 ONETEP 0.001012704842570429 Polymorph 0.0019333456085435462 QMERA 1.8412815319462345E-4 QSAR 0.001012704842570429 Quantum Mechanics 0.5539495488860247 Reflex 0.05459399742220585 Reflex Plus 8.285766893758056E-4 Semi-empirical 0.007641318357576874 Sorption 0.054962253728595103 Synthia 0.0015650893021542994 TURBOMOLE 5.523844595838704E-4 VAMP 0.0015650893021542994 Visualization 0.8510403240655496 X-Cell 0.0012888970723623642 ZDOCK 0.030289081200515558

Year

2021 0.0028087422101290265 2022 0.19064337751250768 2023 0.37250943561836214 2024 0.7505485824629158 2025 1.0 2026 0.37312384797682785 2027 0.0

Keywords

target 1.0 potential 0.27601179094964945 docking 0.22175748884639898 visualization 0.20932919056724028 analysis 0.18877469725940088 between 0.15228648820905036 novel 0.10101975780752072 energy 0.08432919056724028 binding 0.07309592096876992 cell 0.06218132568514978 promising 0.05373645634161887 activity 0.0531389420012747 interaction 0.03792224346717655 stability 0.033739643084767366 synthesized 0.030951242829827915 experimental 0.028760356915232634 performance 0.023860739324410452 protein 0.02131134480560867 effective 0.01971797323135755 mechanism 0.019160293180369662 development 0.019000956022944552 including 0.014698852772466539 synthesis 0.013623326959847037 design 0.0019518801784576163 chemical 0.0
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