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Application

Discovery Studio 1.0 Materials Studio 0.7271397220190198 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.09417040358744394 Amorphous Cell 0.13228699551569506 Blends 5.605381165919282E-4 CASTEP 0.3094170403587444 CDOCKER 0.1743273542600897 CHARMm 0.2505605381165919 COMPASS 0.2640134529147982 COMPASS III 0.04204035874439462 COSMObase 0.0 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 5.605381165919282E-4 COSMOquick 0.0 COSMOtherm 0.024103139013452915 Catalyst 0.2617713004484305 Classical Simulations 0.804932735426009 Conformers 5.605381165919282E-4 Crystallization 0.1109865470852018 DFTB Plus 0.0033632286995515697 DMol3 0.14405829596412556 DPD 0.0 Discover 0.0 Forcite 0.3834080717488789 GULP 0.01289237668161435 LUDI 0.0033632286995515697 LibDock 0.05997757847533632 LigandFit 0.002802690582959641 MCSS 5.605381165919282E-4 MODELER 0.10089686098654709 MesoDyn 5.605381165919282E-4 Mesocite 0.0011210762331838565 Mesoscale 0.002802690582959641 Morphology 0.015134529147982063 Polymorph 0.0 QSAR 0.0011210762331838565 Quantum Mechanics 0.4501121076233184 Reflex 0.09417040358744394 Reflex Plus 0.0011210762331838565 Semi-empirical 0.004484304932735426 Sorption 0.03923766816143498 Synthia 0.0016816143497757848 TURBOMOLE 0.0 VAMP 5.605381165919282E-4 Visualization 1.0 X-Cell 0.002802690582959641 ZDOCK 0.0033632286995515697

Year

2021 0.03982843137254902 2022 0.19852941176470587 2023 0.4993872549019608 2024 0.9087009803921569 2025 1.0 2026 0.32536764705882354 2027 0.0

Keywords

synthesized 1.0 target 0.9558145180869143 synthesis 0.3491138625880068 docking 0.34571497936392326 potential 0.2770089827628065 novel 0.26681233309055596 visualization 0.2539451323136684 compound 0.17407137654770574 analysis 0.1551347414420976 activity 0.12672978878368535 promising 0.09638261714008255 binding 0.08861374119932022 between 0.0721048798252003 design 0.06312211701869386 designed 0.05511046370478272 inhibition 0.05462490895848507 vitro 0.054382131585336245 potent 0.05268268997329449 experimental 0.02889050740470988 effective 0.024520514688031077 silico 0.014809419762078174 cell 0.013109978150036417 active 0.01043942704539937 energy 0.008497208060208788 development 0.0
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