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Application

Discovery Studio 0.8295566502463054 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06541516245487365 Amorphous Cell 0.29140794223826716 Blends 0.0021660649819494585 CASTEP 0.37790613718411553 CDOCKER 0.14570397111913358 CHARMm 0.23465703971119134 COMPASS 0.3633212996389892 COMPASS III 0.09805054151624548 COSMObase 0.004187725631768953 COSMOconf 0.005487364620938628 COSMOmic 0.0 COSMOperm 0.0010108303249097472 COSMOplex 1.444043321299639E-4 COSMOquick 0.001588447653429603 COSMOtherm 0.06685920577617328 Cantera 0.0 Catalyst 0.08173285198555957 Classical Simulations 1.0 Conformers 4.332129963898917E-4 Crystallization 0.07422382671480145 DFTB Plus 0.005487364620938628 DMol3 0.16895306859205775 DPD 0.002454873646209386 Discover 0.003754512635379061 Forcite 0.5548014440433213 GULP 0.021083032490974728 Kinetix 2.888086642599278E-4 LUDI 0.0033212996389891695 LibDock 0.0628158844765343 LigandFit 0.0036101083032490976 MCSS 4.332129963898917E-4 MODELER 0.2155956678700361 MesoDyn 8.664259927797834E-4 Mesocite 0.002888086642599278 Mesoscale 0.005776173285198556 Modules 0.0 Morphology 0.017184115523465705 ONETEP 0.0010108303249097472 Polymorph 0.0020216606498194944 QMERA 1.444043321299639E-4 QSAR 0.0010108303249097472 Quantum Mechanics 0.536028880866426 Reflex 0.0540072202166065 Reflex Plus 0.0011552346570397113 Semi-empirical 0.007075812274368231 Sorption 0.05805054151624549 Synthia 0.0011552346570397113 TURBOMOLE 2.888086642599278E-4 VAMP 0.0011552346570397113 Visualization 0.6753790613718411 X-Cell 0.001444043321299639 ZDOCK 0.02527075812274368

Year

2023 0.05718569286785179 2024 0.42835724994645535 2025 1.0 2026 0.4550224887556222 2027 0.0

Keywords

target 1.0 potential 0.2871491469455146 analysis 0.19998624105668686 docking 0.18952944413869016 between 0.16056686846450194 visualization 0.15747110621904237 energy 0.09817006053935058 novel 0.09569345074298294 promising 0.07533021463951568 cell 0.0697578425976885 binding 0.0595074298293891 performance 0.05090809025866813 stability 0.04279031370390754 activity 0.041964777105118325 experimental 0.028893780957622454 including 0.021532746285085304 synthesized 0.020982388552559163 interaction 0.019331315354980737 effective 0.019193725921849203 development 0.016785910842047332 mechanism 0.01657952669235003 enhanced 0.014171711612548156 design 0.0042652724270776 strong 0.0024766097963676388 synthesis 0.0
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