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Application

Discovery Studio 1.0 Materials Studio 0.83539970392302 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.062314138956474724 Amorphous Cell 0.26980264936469317 Blends 0.0021627466882941336 CASTEP 0.35509597188429304 CDOCKER 0.18721276020546093 CHARMm 0.2962962962962963 COMPASS 0.3361719383617194 COMPASS III 0.08650986753176534 COSMObase 0.004190321708569884 COSMOconf 0.003919978372533117 COSMOmic 0.0 COSMOperm 0.0013517166801838335 COSMOplex 1.3517166801838335E-4 COSMOquick 0.0016220600162206002 COSMOtherm 0.060421735604217354 Cantera 0.0 Catalyst 0.12516896458502297 Classical Simulations 1.0 Conformers 8.110300081103001E-4 Crystallization 0.0665044606650446 DFTB Plus 0.005136523384698567 DMol3 0.15720464990537983 DPD 0.00202757502027575 Discover 0.0029737766964044337 Forcite 0.51338199513382 GULP 0.020546093538794268 Kinetix 0.0 LUDI 0.0040551500405515 LibDock 0.07948094079480941 LigandFit 0.004731008380643417 MCSS 5.406866720735334E-4 MODELER 0.23992971073263045 MesoDyn 8.110300081103001E-4 Mesocite 0.00283860502838605 Mesoscale 0.005406866720735334 Modules 0.0 Morphology 0.016490943498242767 ONETEP 8.110300081103001E-4 Polymorph 0.00202757502027575 QMERA 0.0 QSAR 8.110300081103001E-4 Quantum Mechanics 0.5018924033522574 Reflex 0.04758042714247094 Reflex Plus 0.0012165450121654502 Semi-empirical 0.006623411732900784 Sorption 0.052311435523114354 Synthia 0.0012165450121654502 TURBOMOLE 2.703433360367667E-4 VAMP 0.0012165450121654502 Visualization 0.8898350905650175 X-Cell 0.0014868883482022169 ZDOCK 0.030954311976209785

Year

2022 0.0 2023 0.25769305206115733 2024 0.48296884071995355 2025 1.0 2026 0.3140119992258564

Keywords

target 1.0 potential 0.30683476332224363 docking 0.25430455845444466 visualization 0.21846728535574622 analysis 0.20959551742251795 between 0.14825191151578823 novel 0.10768691997898792 binding 0.08574096772310745 promising 0.07009864005136286 energy 0.06969007179127999 activity 0.0639117492558221 cell 0.057141189517305783 stability 0.03647930893597152 interaction 0.0329189283838207 protein 0.02714060584836281 synthesized 0.026907138271172592 including 0.02095371505282204 development 0.02031167921554894 mechanism 0.017451701394968773 effective 0.01727660071207611 experimental 0.016809665557695676 performance 0.01605089593182747 synthesis 0.01173174575380844 vitro 9.922372030584253E-4 silico 0.0
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