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Application

Discovery Studio 0.8035714285714286 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06751847676312163 Amorphous Cell 0.2941250156582738 Blends 0.002254791431792559 CASTEP 0.389452586746837 CDOCKER 0.14004760115244896 CHARMm 0.22760866842039335 COMPASS 0.3702868595766003 COMPASS III 0.09307277965677063 COSMObase 0.0038832519103094076 COSMOconf 0.005261180007515971 COSMOmic 1.252661906551422E-4 COSMOperm 0.0012526619065514218 COSMOplex 2.505323813102844E-4 COSMOquick 0.001503194287861706 COSMOtherm 0.0680195415257422 Cantera 0.0 Catalyst 0.0855568082174621 Classical Simulations 1.0 Conformers 5.010647626205688E-4 Crystallization 0.0736565201052236 DFTB Plus 0.006012777151446824 DMol3 0.17374420643868219 DPD 0.0025053238131028436 Discover 0.003507453338343981 Forcite 0.5590630088938995 GULP 0.022046849555305024 Kinetix 2.505323813102844E-4 LUDI 0.003006388575723412 LibDock 0.060628836277088816 LigandFit 0.003507453338343981 MCSS 5.010647626205688E-4 MODELER 0.2049354879118126 MesoDyn 7.51597143930853E-4 Mesocite 0.0031316547663785546 Mesoscale 0.006012777151446824 Modules 0.0 Morphology 0.017537266691719906 ONETEP 0.0011273957158962795 Polymorph 0.002004259050482275 QMERA 1.252661906551422E-4 QSAR 0.0010021295252411375 Quantum Mechanics 0.5521733684078667 Reflex 0.05298759864712514 Reflex Plus 0.0011273957158962795 Semi-empirical 0.007390705248653389 Sorption 0.05887510960791682 Synthia 0.001503194287861706 TURBOMOLE 6.263309532757109E-4 VAMP 0.0010021295252411375 Visualization 0.6780658900162846 X-Cell 0.001503194287861706 ZDOCK 0.024426907177752723

Year

2023 0.09375890567113138 2024 0.4914030588011779 2025 1.0 2026 0.4037237579557329 2027 0.0

Keywords

target 1.0 potential 0.2818171105349988 analysis 0.19626443554089087 docking 0.18671930238039122 between 0.16403488098043836 visualization 0.16014612302616074 energy 0.10393589441432949 novel 0.09686542540655196 promising 0.07353287768088616 cell 0.07300259250530285 binding 0.058272448739099696 performance 0.05090737685599812 stability 0.04519208107471129 activity 0.04006599104407259 experimental 0.03493990101343389 synthesized 0.025983973603582372 interaction 0.025276926702804618 including 0.02433419750176762 effective 0.023686071176054677 mechanism 0.0223898185246288 development 0.019856233796841857 enhanced 0.013316049964647655 design 0.004949328305444261 synthesis 0.0030049493283054443 strong 0.0
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