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Application

Discovery Studio 1.0 Materials Studio 0.9889584595704571 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06831965750981092 Amorphous Cell 0.2771138066357474 Blends 0.0024973242953977882 CASTEP 0.3918123439172315 CDOCKER 0.17222618622904032 CHARMm 0.25998929718159114 COMPASS 0.3630039243667499 COMPASS III 0.07955761683910097 COSMObase 0.0033892258294684267 COSMOconf 0.003745986443096682 COSMOmic 2.675704602211916E-4 COSMOperm 0.001337852301105958 COSMOplex 2.675704602211916E-4 COSMOquick 0.0014270424545130217 COSMOtherm 0.06314662861220122 Cantera 0.0 Catalyst 0.12629325722440243 Classical Simulations 1.0 Conformers 0.0010702818408847663 Crystallization 0.07420620763467713 DFTB Plus 0.005440599357830895 DMol3 0.1782019265073136 DPD 0.0028540849090260435 Discover 0.0035676061362825543 Forcite 0.5338922582946842 GULP 0.025330003567606136 Kinetix 2.675704602211916E-4 LUDI 0.00463788797716732 LibDock 0.07135212272565108 LigandFit 0.006243310738494471 MCSS 8.027113806635748E-4 MODELER 0.17784516589368535 MesoDyn 0.0014270424545130217 Mesocite 0.003835176596503746 Mesoscale 0.007224402425972173 Modules 0.0 Morphology 0.017213699607563325 ONETEP 0.0010702818408847663 Polymorph 0.0017838030681412772 QMERA 1.7838030681412772E-4 QSAR 9.810916874777025E-4 Quantum Mechanics 0.5583303603282198 Reflex 0.054673564038530145 Reflex Plus 8.027113806635748E-4 Semi-empirical 0.007224402425972173 Sorption 0.05565465572600785 Synthia 0.0014270424545130217 TURBOMOLE 5.351409204423831E-4 VAMP 0.0014270424545130217 Visualization 0.8538173385658223 X-Cell 0.00115947199429183 ZDOCK 0.029967891544773455

Year

2021 0.003068560406803437 2022 0.2279502016482553 2023 0.37638085218306155 2024 0.7962475889882518 2025 1.0 2026 0.37269857969489745 2027 0.0

Keywords

target 1.0 potential 0.27482501346050303 docking 0.22117529420813783 visualization 0.210137681716791 analysis 0.18771632951311437 between 0.15314206599492347 novel 0.10322282901315283 energy 0.0854549650026921 binding 0.07260979924621183 cell 0.06195677255595723 activity 0.05372663641258365 promising 0.05268825474963464 interaction 0.03880470733020537 stability 0.03395892623644335 synthesized 0.031112991308360895 experimental 0.028382432120606108 performance 0.02403661256826398 effective 0.020575340358433968 protein 0.02026767171756019 mechanism 0.020190754557341744 development 0.018921621413737405 including 0.015075763402815167 synthesis 0.01396046457964772 design 0.0016537189446965618 chemical 0.0
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