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Application

Discovery Studio 1.0 Materials Studio 0.8066681584247035 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05593536357986327 Amorphous Cell 0.2610316967060286 Blends 0.002175264139216905 CASTEP 0.29241765071472964 CDOCKER 0.18986948415164698 CHARMm 0.3098197638284649 COMPASS 0.32224984462399003 COMPASS III 0.10099440646364201 COSMObase 0.0046612802983219395 COSMOconf 0.006525792417650715 COSMOmic 0.0 COSMOperm 6.215040397762585E-4 COSMOplex 3.1075201988812925E-4 COSMOquick 3.1075201988812925E-4 COSMOtherm 0.060907395898073334 Catalyst 0.08452454940957116 Classical Simulations 1.0 Conformers 3.1075201988812925E-4 Crystallization 0.0689869484151647 DFTB Plus 0.002486016159105034 DMol3 0.13455562461155998 DPD 0.001243008079552517 Discover 0.0046612802983219395 Forcite 0.4947172156619018 GULP 0.013983840894965818 Kinetix 0.0 LUDI 0.004972032318210068 LibDock 0.08048477315102548 LigandFit 0.00435052827843381 MCSS 3.1075201988812925E-4 MODELER 0.2952144188937228 MesoDyn 6.215040397762585E-4 Mesocite 0.003107520198881293 Mesoscale 0.004972032318210068 Morphology 0.015848353014294592 ONETEP 6.215040397762585E-4 Polymorph 0.0018645121193287756 QMERA 0.0 QSAR 3.1075201988812925E-4 Quantum Mechanics 0.41889372280919823 Reflex 0.05034182722187694 Reflex Plus 0.0 Semi-empirical 0.004039776258545681 Sorption 0.052827843380981974 Synthia 6.215040397762585E-4 TURBOMOLE 0.0 VAMP 9.322560596643878E-4 Visualization 0.7684897451833437 X-Cell 0.001243008079552517 ZDOCK 0.03356121814791796

Year

2024 0.2924107142857143 2025 1.0 2026 0.855406746031746 2027 0.0

Keywords

target 1.0 potential 0.33768376837683767 docking 0.2668766876687669 analysis 0.23537353735373537 visualization 0.18871887188718872 between 0.13741374137413742 novel 0.1035103510351035 binding 0.10201020102010201 promising 0.09855985598559856 activity 0.061506150615061504 cell 0.0537053705370537 energy 0.05340534053405341 stability 0.04215421542154216 including 0.030453045304530454 strong 0.024902490249024904 development 0.020102010201020103 performance 0.019051905190519053 effective 0.018001800180018002 protein 0.015451545154515451 mechanism 0.014251425142514252 synthesized 0.013501350135013501 therapeutic 0.013351335133513352 interaction 0.009600960096009602 enhanced 0.004500450045004501 synthesis 0.0
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