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Application

Discovery Studio 0.8087468460891506 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06351931330472103 Amorphous Cell 0.29377682403433475 Blends 0.002145922746781116 CASTEP 0.3448497854077253 CDOCKER 0.1463519313304721 CHARMm 0.2349785407725322 COMPASS 0.35321888412017166 COMPASS III 0.1111587982832618 COSMObase 0.00536480686695279 COSMOconf 0.006652360515021459 COSMOmic 0.0 COSMOperm 4.2918454935622315E-4 COSMOplex 2.1459227467811158E-4 COSMOquick 0.001072961373390558 COSMOtherm 0.06931330472103005 Catalyst 0.06609442060085836 Classical Simulations 1.0 Conformers 4.2918454935622315E-4 Crystallization 0.07360515021459227 DFTB Plus 0.00407725321888412 DMol3 0.1592274678111588 DPD 0.0023605150214592273 Discover 0.004291845493562232 Forcite 0.5476394849785408 GULP 0.019313304721030045 Kinetix 2.1459227467811158E-4 LUDI 0.003648068669527897 LibDock 0.06072961373390558 LigandFit 0.0034334763948497852 MCSS 0.0 MODELER 0.2203862660944206 MesoDyn 6.437768240343348E-4 Mesocite 0.003218884120171674 Mesoscale 0.006008583690987125 Modules 0.0 Morphology 0.016738197424892704 ONETEP 8.583690987124463E-4 Polymorph 0.0019313304721030042 QMERA 2.1459227467811158E-4 QSAR 6.437768240343348E-4 Quantum Mechanics 0.4946351931330472 Reflex 0.053433476394849785 Reflex Plus 6.437768240343348E-4 Semi-empirical 0.005579399141630901 Sorption 0.060085836909871244 Synthia 0.001072961373390558 TURBOMOLE 2.1459227467811158E-4 VAMP 8.583690987124463E-4 Visualization 0.6152360515021459 X-Cell 0.0015021459227467812 ZDOCK 0.02424892703862661

Year

2024 0.2599229609780606 2025 1.0 2026 0.7049070507452688 2027 0.0

Keywords

target 1.0 potential 0.28905141360113523 analysis 0.20532692937452243 docking 0.1838227267765528 between 0.1492195175199214 visualization 0.1354655605283266 energy 0.0907106211112324 novel 0.08285121711603537 promising 0.0815413164501692 cell 0.06789651784739657 performance 0.057308154131645014 binding 0.05436087763344613 stability 0.0401702870865626 activity 0.029254448204344505 enhanced 0.019648509987992578 including 0.019430193210348216 experimental 0.017028708656260234 effective 0.015718807990394063 strong 0.013535640213950442 synthesized 0.011898264381617727 mechanism 0.01004257177164065 development 0.009278463049885383 strategy 0.0041480187752428775 design 0.0028381181093767058 interaction 0.0
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