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Application

Discovery Studio 1.0 Materials Studio 0.9722710898885817 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06524869834939626 Amorphous Cell 0.27528525534507586 Blends 0.002437133045308519 CASTEP 0.3796388611941952 CDOCKER 0.16849451645064806 CHARMm 0.2657582807134153 COMPASS 0.35249806137144124 COMPASS III 0.08729367453195967 COSMObase 0.00387725711753628 COSMOconf 0.004652708541043536 COSMOmic 1.1077877478675086E-4 COSMOperm 0.0013293452974410102 COSMOplex 2.2155754957350172E-4 COSMOquick 0.001550902847014512 COSMOtherm 0.06369779550238175 Cantera 0.0 Catalyst 0.12108120084191869 Classical Simulations 1.0 Conformers 6.646726487205051E-4 Crystallization 0.07134153096266756 DFTB Plus 0.005871275063697796 DMol3 0.16915918909936856 DPD 0.00254791182009527 Discover 0.003323363243602526 Forcite 0.5301872161293896 GULP 0.022820427606070677 Kinetix 2.2155754957350172E-4 LUDI 0.00387725711753628 LibDock 0.07244931871053506 LigandFit 0.005206602414977291 MCSS 5.538938739337543E-4 MODELER 0.20228204276060707 MesoDyn 9.970089730807576E-4 Mesocite 0.003212584468815775 Mesoscale 0.006314390162844799 Modules 0.0 Morphology 0.01672759499279938 ONETEP 0.0011077877478675086 Polymorph 0.0019940179461615153 QMERA 1.1077877478675086E-4 QSAR 0.0011077877478675086 Quantum Mechanics 0.5377201728148887 Reflex 0.0518444666001994 Reflex Plus 9.970089730807576E-4 Semi-empirical 0.007311399135925557 Sorption 0.056054060042095934 Synthia 0.001550902847014512 TURBOMOLE 5.538938739337543E-4 VAMP 0.0011077877478675086 Visualization 0.835050404342528 X-Cell 0.0014401240722277612 ZDOCK 0.029134817768915477

Year

2022 0.023652267047483043 2023 0.3238129239557301 2024 0.5293645126740449 2025 1.0 2026 0.37932881113887895 2027 0.0

Keywords

target 1.0 potential 0.2920611798980335 docking 0.23151250303471715 visualization 0.20907987375576595 analysis 0.20189366351056082 between 0.15532896334061666 novel 0.10589949016751639 energy 0.0871570769604273 binding 0.07856275795095898 promising 0.06778344258315125 cell 0.06414178198591891 activity 0.058752124302015055 stability 0.04073804321437242 interaction 0.03758193736343773 synthesized 0.03238650157805292 performance 0.03122117018693858 experimental 0.02986161689730517 development 0.024083515416363194 effective 0.02286962855061908 protein 0.022772517601359555 mechanism 0.022238407380432142 including 0.021995630007283322 synthesis 0.01636319495023064 design 0.005195435785384802 chemical 0.0
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