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Application

Discovery Studio 0.8609491415613865 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06877101637921683 Amorphous Cell 0.28582275734895324 Blends 0.0026033192320208264 CASTEP 0.3920164876884695 CDOCKER 0.14828072459051958 CHARMm 0.23690205011389523 COMPASS 0.368586614600282 COMPASS III 0.08807896735003796 COSMObase 0.0039049788480312398 COSMOconf 0.004447337021368912 COSMOmic 1.0847163466753444E-4 COSMOperm 0.0014101312506779478 COSMOplex 2.1694326933506888E-4 COSMOquick 0.0015186028853454822 COSMOtherm 0.06421520772318039 Cantera 0.0 Catalyst 0.09990237552879921 Classical Simulations 1.0 Conformers 8.677730773402755E-4 Crystallization 0.07614708753660918 DFTB Plus 0.005532053368044257 DMol3 0.17789348085475648 DPD 0.0026033192320208264 Discover 0.0033626206746935677 Forcite 0.5506020175724048 GULP 0.024080702896192647 Kinetix 3.254149040026033E-4 LUDI 0.003471092309361102 LibDock 0.06356437791517518 LigandFit 0.004230393752033843 MCSS 5.423581733376722E-4 MODELER 0.19101854864952814 MesoDyn 0.0010847163466753444 Mesocite 0.0037965072133637054 Mesoscale 0.006725241349387135 Modules 0.0 Morphology 0.017680876450808115 ONETEP 0.0010847163466753444 Polymorph 0.0019524894240156199 QMERA 1.0847163466753444E-4 QSAR 9.762447120078099E-4 Quantum Mechanics 0.5586289185378024 Reflex 0.0557544202191127 Reflex Plus 9.762447120078099E-4 Semi-empirical 0.0072675995227248075 Sorption 0.059008569259138735 Synthia 0.0014101312506779478 TURBOMOLE 6.508298080052066E-4 VAMP 0.0014101312506779478 Visualization 0.7372817008352316 X-Cell 0.0014101312506779478 ZDOCK 0.024948475973532922

Year

2022 8.89284126278346E-5 2023 0.2390395731436194 2024 0.5852378835037795 2025 1.0 2026 0.37803468208092483 2027 0.0

Keywords

target 1.0 potential 0.27877276128710404 docking 0.19531055125966576 analysis 0.1908206535295585 visualization 0.17645298079321525 between 0.15694686954352707 novel 0.0958343726615116 energy 0.09443751558992268 cell 0.0642055375405338 promising 0.06181092541780993 binding 0.05786979296582689 activity 0.04095784484908955 stability 0.038214018458468446 performance 0.037864804190571213 experimental 0.030281865801945623 interaction 0.027937141431778497 synthesized 0.02549264155649788 effective 0.018159141930656025 including 0.017410825642304815 mechanism 0.01711149912696433 development 0.01641307059116987 synthesis 0.0036916936891993016 protein 0.00279371414317785 enhanced 3.9910202045397855E-4 design 0.0
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