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Application

Discovery Studio 0.8192257825523245 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06394525719679094 Amorphous Cell 0.294478527607362 Blends 0.0018876828692779614 CASTEP 0.341670599339311 CDOCKER 0.1479471448796602 CHARMm 0.23430863614912695 COMPASS 0.35276073619631904 COMPASS III 0.11137328928739972 COSMObase 0.005427088249174139 COSMOconf 0.0066068900424728644 COSMOmic 0.0 COSMOperm 4.7192071731949034E-4 COSMOplex 2.3596035865974517E-4 COSMOquick 9.438414346389807E-4 COSMOtherm 0.06913638508730534 Catalyst 0.06724870221802737 Classical Simulations 1.0 Conformers 4.7192071731949034E-4 Crystallization 0.07479943369513922 DFTB Plus 0.004247286455875413 DMol3 0.158329400660689 DPD 0.0023596035865974517 Discover 0.004719207173194903 Forcite 0.5500235960358659 GULP 0.019112789051439358 Kinetix 2.3596035865974517E-4 LUDI 0.004011326097215668 LibDock 0.06134969325153374 LigandFit 0.0035394053798961773 MCSS 0.0 MODELER 0.22321849929211893 MesoDyn 7.078810759792355E-4 Mesocite 0.0035394053798961773 Mesoscale 0.006370929683813119 Morphology 0.017225106182161398 ONETEP 9.438414346389807E-4 Polymorph 0.0021236432279377066 QMERA 2.3596035865974517E-4 QSAR 7.078810759792355E-4 Quantum Mechanics 0.4915054270882492 Reflex 0.05403492213308164 Reflex Plus 4.7192071731949034E-4 Semi-empirical 0.005899008966493629 Sorption 0.060169891458235016 Synthia 0.0011798017932987258 TURBOMOLE 2.3596035865974517E-4 VAMP 9.438414346389807E-4 Visualization 0.6238791882963662 X-Cell 0.0016517225106182161 ZDOCK 0.02406795658329401

Year

2024 0.22808320950965824 2025 1.0 2026 0.7607726597325408 2027 0.0

Keywords

target 1.0 potential 0.2935647143890094 analysis 0.21005061460592914 docking 0.18739455290431428 between 0.1465413352615088 visualization 0.14087731983610507 energy 0.09002169197396963 promising 0.08568329718004339 novel 0.08303205591708845 cell 0.06845022897083634 performance 0.05796577488551458 binding 0.05700168715353097 stability 0.04386599180525428 activity 0.03289949385394071 including 0.022656061701614848 enhanced 0.02193299590262714 experimental 0.019161243673174257 strong 0.017835623041696794 effective 0.015063870812243915 mechanism 0.01277416244878284 synthesized 0.012412629549288986 development 0.010363943118823812 strategy 0.0066281031573873226 design 0.0032537960954446853 interaction 0.0
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