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Application

Discovery Studio 1.0 Materials Studio 0.962621011115095 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06451996197718632 Amorphous Cell 0.27566539923954375 Blends 0.002376425855513308 CASTEP 0.3736929657794677 CDOCKER 0.16955798479087453 CHARMm 0.2688925855513308 COMPASS 0.34933460076045625 COMPASS III 0.09018536121673004 COSMObase 0.004158745247148289 COSMOconf 0.004871673003802281 COSMOmic 1.188212927756654E-4 COSMOperm 0.001188212927756654 COSMOplex 2.376425855513308E-4 COSMOquick 0.0015446768060836502 COSMOtherm 0.0625 Cantera 0.0 Catalyst 0.11692015209125475 Classical Simulations 1.0 Conformers 7.129277566539924E-4 Crystallization 0.07046102661596958 DFTB Plus 0.005465779467680608 DMol3 0.16694391634980987 DPD 0.0021387832699619773 Discover 0.003326996197718631 Forcite 0.5299429657794676 GULP 0.021744296577946767 Kinetix 2.376425855513308E-4 LUDI 0.0038022813688212928 LibDock 0.0721245247148289 LigandFit 0.004515209125475285 MCSS 4.752851711026616E-4 MODELER 0.21316539923954372 MesoDyn 8.317490494296577E-4 Mesocite 0.0030893536121673003 Mesoscale 0.005703422053231939 Modules 0.0 Morphology 0.016397338403041826 ONETEP 0.0010693916349809886 Polymorph 0.0020199619771863117 QMERA 1.188212927756654E-4 QSAR 8.317490494296577E-4 Quantum Mechanics 0.529467680608365 Reflex 0.05109315589353612 Reflex Plus 0.0010693916349809886 Semi-empirical 0.006891634980988593 Sorption 0.05655893536121673 Synthia 0.0013070342205323193 TURBOMOLE 4.752851711026616E-4 VAMP 0.0010693916349809886 Visualization 0.8284220532319392 X-Cell 0.0015446768060836502 ZDOCK 0.028873574144486693

Year

2022 0.0 2023 0.282411230388109 2024 0.4839893568217268 2025 1.0 2026 0.3903110377098816 2027 3.6700614735296817E-4

Keywords

target 1.0 potential 0.29597096570587 docking 0.23364191037239637 visualization 0.2070271407532085 analysis 0.20576478013885965 between 0.1564275194613928 novel 0.10640648011782032 energy 0.08510414475068379 binding 0.07900273511466442 promising 0.07132337471070903 cell 0.06432779297285925 activity 0.0584893751314959 stability 0.041552703555649065 interaction 0.03429413002314328 performance 0.03176940879444561 synthesized 0.03150641699978961 experimental 0.02698295813170629 development 0.022827687776141383 including 0.022512097622554177 effective 0.02224910582789817 protein 0.022038712392173365 mechanism 0.02030296654744372 synthesis 0.01330738480959394 design 0.004313065432358511 enhanced 0.0
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