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Application

Discovery Studio 1.0 Materials Studio 0.9937001799948573 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06822478089018731 Amorphous Cell 0.2741020793950851 Blends 0.002835538752362949 CASTEP 0.4041931603368276 CDOCKER 0.17271008764392506 CHARMm 0.2594088331328407 COMPASS 0.3704244715586871 COMPASS III 0.07673139714727617 COSMObase 0.0030933150025777623 COSMOconf 0.003694792919745661 COSMOmic 2.5777625021481353E-4 COSMOperm 0.0012888812510740678 COSMOplex 3.4370166695308474E-4 COSMOquick 0.0017185083347654236 COSMOtherm 0.06263962880219968 Cantera 0.0 Catalyst 0.11935040384945866 Classical Simulations 1.0 Conformers 0.0010311050008592541 Crystallization 0.07561436672967864 DFTB Plus 0.005585152087987627 DMol3 0.18405224265337686 DPD 0.002749613335624678 Discover 0.004210345420175288 Forcite 0.5337686887781405 GULP 0.02534799793779 Kinetix 2.5777625021481353E-4 LUDI 0.005155525004296271 LibDock 0.07037291630864409 LigandFit 0.0073036604227530505 MCSS 0.0011170304175975253 MODELER 0.1925588589104657 MesoDyn 0.0012888812510740678 Mesocite 0.003694792919745661 Mesoscale 0.006959958755799966 Modules 0.0 Morphology 0.01727100876439251 ONETEP 0.00146073208455061 Polymorph 0.0018044337515036948 QMERA 1.7185083347654237E-4 QSAR 0.0012888812510740678 Quantum Mechanics 0.5763017700635849 Reflex 0.05602337171335281 Reflex Plus 7.733287506444406E-4 Semi-empirical 0.0073036604227530505 Sorption 0.05533596837944664 Synthia 0.0012888812510740678 TURBOMOLE 5.155525004296271E-4 VAMP 0.001374806667812339 Visualization 0.8593400927994501 X-Cell 0.0012888812510740678 ZDOCK 0.030073895858394914

Year

2020 0.020246478873239437 2021 0.1301056338028169 2022 0.1619718309859155 2023 0.43794014084507044 2024 0.7973591549295774 2025 1.0 2026 0.3742077464788732 2027 0.0

Keywords

target 1.0 potential 0.26585858585858585 docking 0.21502295684113865 visualization 0.20811753902662994 analysis 0.18233241505968778 between 0.15213957759412305 novel 0.09983471074380165 energy 0.08356290174471992 binding 0.07056014692378329 cell 0.058292011019283746 activity 0.051423324150596875 promising 0.04955004591368228 interaction 0.03761248852157943 stability 0.028980716253443527 experimental 0.02662993572084481 synthesized 0.026593204775022958 mechanism 0.018806244260789716 performance 0.018585858585858588 effective 0.018292011019283745 protein 0.017704315886134067 development 0.016639118457300275 synthesis 0.011974288337924702 including 0.009917355371900827 design 6.244260789715335E-4 chemical 0.0
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