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Application

Discovery Studio 1.0 Materials Studio 0.9464376980476337 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06373565602101479 Amorphous Cell 0.2742983547628923 Blends 0.002626849163555924 CASTEP 0.37674547214157333 CDOCKER 0.17599889395824692 CHARMm 0.26572653117655193 COMPASS 0.3609843771602378 COMPASS III 0.08779206415042168 COSMObase 0.003871146135766625 COSMOconf 0.004285911793170193 COSMOmic 1.3825521913452232E-4 COSMOperm 0.0013825521913452233 COSMOplex 4.1476565740356696E-4 COSMOquick 9.677865339416563E-4 COSMOtherm 0.06373565602101479 Catalyst 0.12055855108530347 Classical Simulations 1.0 Conformers 5.530208765380893E-4 Crystallization 0.07382828701783492 DFTB Plus 0.00594497442278446 DMol3 0.17102170606940412 DPD 0.003041614820959491 Discover 0.004009401354901148 Forcite 0.5242637909581087 GULP 0.024056408129406886 Kinetix 2.7651043826904464E-4 LUDI 0.003871146135766625 LibDock 0.07396654223696944 LigandFit 0.005391953546246371 MCSS 1.3825521913452232E-4 MODELER 0.20102308862159546 MesoDyn 9.677865339416563E-4 Mesocite 0.00414765657403567 Mesoscale 0.007189271394995161 Modules 0.0 Morphology 0.01728190239181529 ONETEP 9.677865339416563E-4 Polymorph 0.002488593944421402 QMERA 2.7651043826904464E-4 QSAR 8.295313148071339E-4 Quantum Mechanics 0.5371215263376192 Reflex 0.053504769805060144 Reflex Plus 9.677865339416563E-4 Semi-empirical 0.00774229227153325 Sorption 0.05626987418775059 Synthia 0.002073828287017835 TURBOMOLE 2.7651043826904464E-4 VAMP 0.001244296972210701 Visualization 0.8528964468408683 X-Cell 0.0011060417530761786 ZDOCK 0.031660445181805615

Year

2021 0.004214408007375214 2022 0.19978927959963125 2023 0.2826287369946003 2024 0.6849730014487028 2025 1.0 2026 0.5154747794020809 2027 0.0

Keywords

target 1.0 potential 0.2886996436552516 docking 0.23385879084375188 visualization 0.21362565682188803 analysis 0.1996134565440599 between 0.1541342030561092 novel 0.10666183487346742 energy 0.0838316120070061 binding 0.08129492057739929 promising 0.06722232288458053 cell 0.06619556682973969 activity 0.06178655553542308 stability 0.0393187171589056 interaction 0.03786917919913028 synthesized 0.03648003865434559 experimental 0.030500694570272394 performance 0.027360028990759195 development 0.026333272935918344 protein 0.024400555656217914 effective 0.024340158241227275 mechanism 0.021259890076704716 including 0.02077671075677961 synthesis 0.016548891707434923 design 0.006220933744035755 silico 0.0
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