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Application

Discovery Studio 0.8013925152306354 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.061927118265146436 Amorphous Cell 0.2899619941873463 Blends 0.002012072434607646 CASTEP 0.3494299128101945 CDOCKER 0.14330427006483346 CHARMm 0.23295327520679635 COMPASS 0.3639615470601386 COMPASS III 0.10619271182651464 COSMObase 0.004247708473060586 COSMOconf 0.005141962888441762 COSMOmic 2.23563603845294E-4 COSMOperm 8.94254415381176E-4 COSMOplex 2.23563603845294E-4 COSMOquick 0.001564945226917058 COSMOtherm 0.06393919069975408 Catalyst 0.06930471719204113 Classical Simulations 1.0 Conformers 2.23563603845294E-4 Crystallization 0.07265817124972054 DFTB Plus 0.004024144869215292 DMol3 0.158953722334004 DPD 0.001788508830762352 Discover 0.00335345405767941 Forcite 0.5524256651017214 GULP 0.02079141515761234 Kinetix 0.0 LUDI 0.002012072434607646 LibDock 0.0628213726805276 LigandFit 0.002906326849988822 MCSS 0.0 MODELER 0.21797451374916163 MesoDyn 6.706908115358819E-4 Mesocite 0.003577017661524704 Mesoscale 0.00558909009613235 Modules 0.0 Morphology 0.01676727028839705 ONETEP 6.706908115358819E-4 Polymorph 0.0024591996422982337 QMERA 0.0 QSAR 4.47127207690588E-4 Quantum Mechanics 0.4978761457634697 Reflex 0.05276101050748938 Reflex Plus 0.0013413816230717639 Semi-empirical 0.005141962888441762 Sorption 0.05857366420746703 Synthia 0.0013413816230717639 TURBOMOLE 2.23563603845294E-4 VAMP 6.706908115358819E-4 Visualization 0.6217303822937625 X-Cell 0.0011178180192264698 ZDOCK 0.024591996422982338

Year

2023 5.20471894517696E-4 2024 0.3294587092297016 2025 1.0 2026 0.614677307425399 2027 0.0

Keywords

target 1.0 potential 0.2887189292543021 analysis 0.1988527724665392 docking 0.17860758069958385 between 0.1556630300303678 visualization 0.14194128894387584 energy 0.09728939376897987 novel 0.09369024856596558 promising 0.08300528624451693 cell 0.06928354515802497 binding 0.056686536947474976 performance 0.05499943763356203 stability 0.04521426161286694 activity 0.032504780114722756 including 0.024406703407940614 effective 0.021819817793274097 experimental 0.01923293217860758 mechanism 0.018108199302665617 development 0.015183893825216512 enhanced 0.014958947250028118 interaction 0.013496794511303565 synthesized 0.011697221909796423 strong 0.008323023281970533 design 0.001799572601507142 strategy 0.0
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