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Application

Discovery Studio 0.9846782431052093 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06389359760073021 Amorphous Cell 0.28152301473464597 Blends 0.0019559264571652104 CASTEP 0.3649758769070283 CDOCKER 0.16260268613900117 CHARMm 0.2598774286086843 COMPASS 0.3531099230668927 COMPASS III 0.09297170426391968 COSMObase 0.004042248011474768 COSMOconf 0.0050854087886295475 COSMOmic 1.3039509714434736E-4 COSMOperm 0.0011735558742991263 COSMOplex 1.3039509714434736E-4 COSMOquick 0.0015647411657321686 COSMOtherm 0.06454557308645195 Cantera 0.0 Catalyst 0.10353370713261181 Classical Simulations 1.0 Conformers 6.519754857217369E-4 Crystallization 0.07145651323510235 DFTB Plus 0.0050854087886295475 DMol3 0.16416742730473335 DPD 0.0023471117485982526 Discover 0.0036510627200417264 Forcite 0.5376189855261442 GULP 0.020472030251662537 Kinetix 1.3039509714434736E-4 LUDI 0.0033902725257530316 LibDock 0.06845742600078238 LigandFit 0.004042248011474768 MCSS 5.215803885773895E-4 MODELER 0.2237579866997001 MesoDyn 6.519754857217369E-4 Mesocite 0.0029990872343199897 Mesoscale 0.005606989177206937 Modules 0.0 Morphology 0.016820967531620813 ONETEP 0.001043160777154779 Polymorph 0.0018255313600208632 QMERA 1.3039509714434736E-4 QSAR 9.127656800104316E-4 Quantum Mechanics 0.5187116964402139 Reflex 0.05189724866345025 Reflex Plus 0.0011735558742991263 Semi-empirical 0.006650149954361716 Sorption 0.05711305254922415 Synthia 0.0013039509714434737 TURBOMOLE 3.9118529143304214E-4 VAMP 0.0011735558742991263 Visualization 0.7759812231060113 X-Cell 0.0015647411657321686 ZDOCK 0.027252575303168602

Year

2023 0.1668140288829944 2024 0.4725415070242657 2025 1.0 2026 0.41752627959524513 2027 0.0

Keywords

target 1.0 potential 0.2926569074853316 docking 0.21898891720500208 analysis 0.20387601493510343 visualization 0.18781485213062288 between 0.1523143483672139 novel 0.09974515498133112 energy 0.08344692704320512 promising 0.07064540982634979 binding 0.07034907840929296 cell 0.06270372784922658 activity 0.05126533515083269 stability 0.03923427961832514 performance 0.03348545012742251 synthesized 0.025365969300065194 interaction 0.02477330646595152 experimental 0.02346944823090144 including 0.01979493865939667 effective 0.017483553606353345 development 0.016713091922005572 mechanism 0.016594559355182836 protein 0.01108279499792568 synthesis 0.004800568956320749 enhanced 0.0024299176198660584 design 0.0
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